untitled.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (1)
1

>  <Formula> (1)
C21H23N3O2

>  <MolWeight> (1)
349.42622

>  <Cat> (1)
S1030

>  <Name> (1)
Panobinostat (LBH589)

>  <Synonyms> (1)
NVP-LBH589

>  <Target> (1)
Apoptosis related,Autophagy,HDAC,HIV Protease

>  <Form> (1)
Free Base

>  <CAS> (1)
404950-80-7

>  <URL> (1)
http://selleckchem.com/products/LBH-589.html

$$$$
AR-42.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (2)
2

>  <Formula> (2)
C18H20N2O3

>  <MolWeight> (2)
312.363

>  <Cat> (2)
S2244

>  <Name> (2)
AR-42

>  <Synonyms> (2)
HDAC-42

>  <Target> (2)
HDAC

>  <Form> (2)
free base

>  <CAS> (2)
935881-37-1

>  <URL> (2)
http://selleckchem.com/products/AR-42-HDAC-42.html

$$$$
vorinostat.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (3)
3

>  <Formula> (3)
C14H20N2O3

>  <MolWeight> (3)
264.3202

>  <Cat> (3)
S1047

>  <Name> (3)
Vorinostat (SAHA)

>  <Synonyms> (3)
SAHA,MK0683, Suberoylanilide hydroxamic acid, Zolinza

>  <Target> (3)
Autophagy,HDAC,HPV

>  <Form> (3)
free base

>  <CAS> (3)
149647-78-9

>  <URL> (3)
http://selleckchem.com/products/Vorinostat-saha.html

$$$$
untitled.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (4)
4

>  <Formula> (4)
C23H28N8OS

>  <MolWeight> (4)
464.58642

>  <Cat> (4)
S1048

>  <Name> (4)
Tozasertib

>  <Synonyms> (4)
VX-680, MK-0457

>  <Target> (4)
Aurora Kinase,Autophagy,Bcr-Abl,FLT3

>  <Form> (4)
free base

>  <CAS> (4)
639089-54-6

>  <URL> (4)
http://selleckchem.com/products/VX-680(MK-0457).html

$$$$
untitled.cdx
csChFnd80/07292609462D

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>  <Synonyms> (5)
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>  <Target> (5)
Apoptosis related,Autophagy,HDAC

>  <Form> (5)
free base

>  <CAS> (5)
209783-80-2

>  <URL> (5)
http://selleckchem.com/products/MS-275.html

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>  <Formula> (6)
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>  <Name> (6)
Belinostat (PXD101)

>  <Synonyms> (6)
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>  <Target> (6)
Autophagy,HDAC

>  <Form> (6)
free base

>  <CAS> (6)
866323-14-0

>  <URL> (6)
http://selleckchem.com/products/Belinostat.html

$$$$
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>  <Mol_ID> (7)
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>  <Formula> (7)
C21H23N3O5

>  <MolWeight> (7)
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>  <Cat> (7)
S1090

>  <Name> (7)
Abexinostat (PCI-24781)

>  <Synonyms> (7)
CRA-024781

>  <Target> (7)
HDAC

>  <Form> (7)
free base

>  <CAS> (7)
783355-60-2

>  <URL> (7)
http://selleckchem.com/products/PCI-24781.html

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>  <Formula> (8)
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>  <Name> (8)
Dacinostat (LAQ824)

>  <Synonyms> (8)
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>  <Target> (8)
HDAC,p21

>  <Form> (8)
free base

>  <CAS> (8)
404951-53-7

>  <URL> (8)
http://selleckchem.com/products/LAQ824(NVP-LAQ824).html

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Aurora Kinase

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>  <CAS> (9)
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>  <URL> (9)
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>  <Mol_ID> (10)
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>  <Formula> (10)
C29H31N5O4

>  <MolWeight> (10)
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>  <Cat> (10)
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>  <Name> (10)
ZM 447439

>  <Synonyms> (10)
N/A

>  <Target> (10)
Aurora Kinase

>  <Form> (10)
free base

>  <CAS> (10)
331771-20-1

>  <URL> (10)
http://selleckchem.com/products/ZM-447439.html

$$$$
untitled.cdx
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>  <Mol_ID> (11)
11

>  <Formula> (11)
C26H30N6O3

>  <MolWeight> (11)
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>  <Cat> (11)
S1107

>  <Name> (11)
Danusertib (PHA-739358)

>  <Synonyms> (11)
N/A

>  <Target> (11)
Apoptosis related,Aurora Kinase,Autophagy,Bcr-Abl,c-RET,FGFR,Trk receptor

>  <Form> (11)
free base

>  <CAS> (11)
827318-97-8

>  <URL> (11)
http://selleckchem.com/products/PHA-739358(Danusertib).html

$$$$
untitled.cdx
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>  <Mol_ID> (12)
12

>  <Formula> (12)
C28H39N7O3

>  <MolWeight> (12)
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>  <Cat> (12)
S1109

>  <Name> (12)
BI 2536

>  <Synonyms> (12)
N/A

>  <Target> (12)
Apoptosis related,Autophagy,Epigenetic Reader Domain,Myc,PLK

>  <Form> (12)
free base

>  <CAS> (12)
755038-02-9

>  <URL> (12)
http://selleckchem.com/products/BI-2536.html

$$$$
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M  END
>  <Mol_ID> (13)
13

>  <Formula> (13)
C23H20N6O

>  <MolWeight> (13)
396.4445

>  <Cat> (13)
S1122

>  <Name> (13)
Mocetinostat (MGCD0103)

>  <Synonyms> (13)
MG0103

>  <Target> (13)
Apoptosis related,Autophagy,HDAC

>  <Form> (13)
free base

>  <CAS> (13)
726169-73-9

>  <URL> (13)
http://selleckchem.com/products/MGCD0103(Mocetinostat).html

$$$$
SRT1720.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (14)
14

>  <Formula> (14)
C25H24ClN7OS

>  <MolWeight> (14)
506.02236

>  <Cat> (14)
S1129

>  <Name> (14)
SRT1720 HCl

>  <Synonyms> (14)
N/A

>  <Target> (14)
Autophagy,Sirtuin

>  <Form> (14)
Hydrochloride

>  <CAS> (14)
1001645-58-4

>  <URL> (14)
http://selleckchem.com/products/SRT1720.html

$$$$
mln8237.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (15)
15

>  <Formula> (15)
C27H20ClFN4O4

>  <MolWeight> (15)
518.9235032

>  <Cat> (15)
S1133

>  <Name> (15)
Alisertib (MLN8237)

>  <Synonyms> (15)
N/A

>  <Target> (15)
Apoptosis related,Aurora Kinase,Autophagy

>  <Form> (15)
free base

>  <CAS> (15)
1028486-01-2

>  <URL> (15)
http://selleckchem.com/products/MLN8237.html

$$$$
AT9283.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (16)
16

>  <Formula> (16)
C19H23N7O2

>  <MolWeight> (16)
381.43162

>  <Cat> (16)
S1134

>  <Name> (16)
AT9283

>  <Synonyms> (16)
N/A

>  <Target> (16)
Aurora Kinase,Bcr-Abl,JAK

>  <Form> (16)
free base

>  <CAS> (16)
896466-04-9

>  <URL> (16)
http://selleckchem.com/products/AT9283.html

$$$$
untitled.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (17)
17

>  <Formula> (17)
C26H30FN7O3

>  <MolWeight> (17)
507.5599032

>  <Cat> (17)
S1147

>  <Name> (17)
Barasertib (AZD1152-HQPA)

>  <Synonyms> (17)
AZD2811, INH-34, Barasertib-HQPA , Defosbarasertib

>  <Target> (17)
Aurora Kinase

>  <Form> (17)
free base

>  <CAS> (17)
722544-51-6

>  <URL> (17)
http://selleckchem.com/products/AZD1152-HQPA.html

$$$$
cyc116.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (18)
18

>  <Formula> (18)
C18H20N6OS

>  <MolWeight> (18)
368.456

>  <Cat> (18)
S1171

>  <Name> (18)
CYC116

>  <Synonyms> (18)
N/A

>  <Target> (18)
Aurora Kinase,VEGFR

>  <Form> (18)
free base

>  <CAS> (18)
693228-63-6

>  <URL> (18)
http://selleckchem.com/products/CYC116.html

$$$$
ENMD-2076.cdx
csChFnd80/07292609462D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (19)
19

>  <Formula> (19)
C21H25N7

>  <MolWeight> (19)
375.4701

>  <Cat> (19)
S1181

>  <Name> (19)
ENMD-2076

>  <Synonyms> (19)
N/A

>  <Target> (19)
Apoptosis related,Aurora Kinase,CSF-1R,FGFR,FLT3,PDGFR,Src,VEGFR

>  <Form> (19)
Tartaric Acid

>  <CAS> (19)
934353-76-1

>  <URL> (19)
http://selleckchem.com/products/enmd-2076.html

$$$$
S119401 CUDC-101.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (20)
20

>  <Formula> (20)
C24H26N4O4

>  <MolWeight> (20)
434.48764

>  <Cat> (20)
S1194

>  <Name> (20)
CUDC-101

>  <Synonyms> (20)
N/A

>  <Target> (20)
EGFR,HDAC,HER2

>  <Form> (20)
free base

>  <CAS> (20)
1012054-59-9

>  <URL> (20)
http://selleckchem.com/products/CUDC-101.html

$$$$
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csChFnd80/07292609462D

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 18 27  2  0  0  0  0
M  END
>  <Mol_ID> (21)
21

>  <Formula> (21)
C15H12F2N6O3S

>  <MolWeight> (21)
394.3559864

>  <Cat> (21)
S1249

>  <Name> (21)
JNJ-7706621

>  <Synonyms> (21)
N/A

>  <Target> (21)
Aurora Kinase,CDK

>  <Form> (21)
free base

>  <CAS> (21)
443797-96-4

>  <URL> (21)
http://selleckchem.com/products/JNJ-7706621.html

$$$$
Nicotinamide.cdx
csChFnd80/07292609462D

  9  9  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    4.1927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  3  4  2  0  0  0  0
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  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
M  END
>  <Mol_ID> (22)
22

>  <Formula> (22)
C6H6N2O

>  <MolWeight> (22)
122.12464

>  <Cat> (22)
S1899

>  <Name> (22)
Nicotinamide (NSC 13128)

>  <Synonyms> (22)
Niacinamide, Vitamin PP, Nicotinic acid amide, Vitamin B3, NSC 27452,NSC 13128

>  <Target> (22)
Sirtuin

>  <Form> (22)
free base

>  <CAS> (22)
98-92-0

>  <URL> (22)
http://selleckchem.com/products/Nicotinamide(Niacinamide).html

$$$$
resveratrol.cdx
csChFnd80/07292609462D

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    1.3476    3.5226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7099    2.1703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0622    1.8080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0522    2.7979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6898    4.1502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3376    4.5126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.3863    3.4233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7339    3.0622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0963    1.7099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4486    1.3476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4385    2.3376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0762    3.6898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7239    4.0522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0627    4.6764    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8096    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  2  0  0  0  0
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 14 16  1  0  0  0  0
 12 17  1  0  0  0  0
M  END
>  <Mol_ID> (23)
23

>  <Formula> (23)
C14H12O3

>  <MolWeight> (23)
228.24328

>  <Cat> (23)
S1396

>  <Name> (23)
Resveratrol (SRT501)

>  <Synonyms> (23)
trans-Resveratrol,SRT501

>  <Target> (23)
AMPK,Apoptosis related,Autophagy,COX,ERK,I¦ÊB/IKK,JNK,Lipoxygenase,Mitophagy,Sirtuin,Src,STAT

>  <Form> (23)
free base

>  <CAS> (23)
501-36-0

>  <URL> (23)
http://selleckchem.com/products/Resveratrol.html

$$$$
Droxinostat.cdx
csChFnd80/07292609462D

 16 16  0  0  0  0  0  0  0  0999 V2000
    1.2124    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8582    0.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    2.8073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2831    2.8073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.7079    2.8073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9204    2.1073    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7079    4.2073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1328    2.8073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
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 13 14  1  0  0  0  0
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M  END
>  <Mol_ID> (24)
24

>  <Formula> (24)
C11H14ClNO3

>  <MolWeight> (24)
243.68676

>  <Cat> (24)
S1422

>  <Name> (24)
Droxinostat

>  <Synonyms> (24)
NS 41080

>  <Target> (24)
HDAC

>  <Form> (24)
free base

>  <CAS> (24)
99873-43-5

>  <URL> (24)
http://selleckchem.com/products/Droxinostat.html

$$$$
Aurora A Inhibitor I.cdx
csChFnd80/07292609462D

 42 46  0  0  0  0  0  0  0  0999 V2000
   10.8867    3.4951    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3115    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3115    3.4951    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.0991    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5198    1.3976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7280    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0991    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   16.9404    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1529    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1529    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9404    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7280    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3611    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5693    3.4951    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.7775    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3611    5.5879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.9900    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2024    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2024    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6289   10.4854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    9.7854    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    8.3854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6289    7.6854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082   10.4830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    9.7854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  3  9  1  0  0  0  0
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 10 11  1  0  0  0  0
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 14  8  1  0  0  0  0
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 41 42  1  0  0  0  0
M  END
>  <Mol_ID> (25)
25

>  <Formula> (25)
C31H31ClFN7O2

>  <MolWeight> (25)
588.0749432

>  <Cat> (25)
S1451

>  <Name> (25)
Aurora A Inhibitor I (TC-S 7010)

>  <Synonyms> (25)
N/A

>  <Target> (25)
Apoptosis related,Aurora Kinase

>  <Form> (25)
free base

>  <CAS> (25)
1158838-45-9

>  <URL> (25)
http://selleckchem.com/products/Aurora-A-Inhibitor-I.html

$$$$
PHA-6806320.cdx
csChFnd80/07292609462D

 37 41  0  0  0  0  0  0  0  0999 V2000
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    6.2892    9.3345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (26)
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>  <MolWeight> (26)
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PHA-680632

>  <Synonyms> (26)
N/A

>  <Target> (26)
Aurora Kinase

>  <Form> (26)
free base

>  <CAS> (26)
398493-79-3

>  <URL> (26)
http://selleckchem.com/products/PHA-680632.html

$$$$
MC-1568.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (27)
27

>  <Formula> (27)
C17H15FN2O3

>  <MolWeight> (27)
314.3110032

>  <Cat> (27)
S1484

>  <Name> (27)
MC1568

>  <Synonyms> (27)
N/A

>  <Target> (27)
HDAC

>  <Form> (27)
free base

>  <CAS> (27)
852475-26-4

>  <URL> (27)
http://selleckchem.com/products/MC1568.html

$$$$
SB 939.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (28)
28

>  <Formula> (28)
C20H30N4O2

>  <MolWeight> (28)
358.4778

>  <Cat> (28)
S1515

>  <Name> (28)
Pracinostat (SB939)

>  <Synonyms> (28)
N/A

>  <Target> (28)
Apoptosis related,HDAC

>  <Form> (28)
free base

>  <CAS> (28)
929016-96-6

>  <URL> (28)
http://selleckchem.com/products/SB939.html

$$$$
Hesperadin .cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (29)
29

>  <Formula> (29)
C29H32N4O3S

>  <MolWeight> (29)
516.65438

>  <Cat> (29)
S1529

>  <Name> (29)
Hesperadin

>  <Synonyms> (29)
N/A

>  <Target> (29)
Aurora Kinase

>  <Form> (29)
free base

>  <CAS> (29)
422513-13-1

>  <URL> (29)
http://selleckchem.com/products/Hesperadin.html

$$$$
EX527.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (30)
30

>  <Formula> (30)
C13H13ClN2O

>  <MolWeight> (30)
248.70812

>  <Cat> (30)
S1541

>  <Name> (30)
Selisistat (EX 527)

>  <Synonyms> (30)
SEN0014196

>  <Target> (30)
Sirtuin

>  <Form> (30)
free base

>  <CAS> (30)
49843-98-3

>  <URL> (30)
http://selleckchem.com/products/EX-527.html

$$$$
DIVALPROEX (divalproex sodium).cdx
csChFnd80/07292609462D

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  1  2  1  0  0  0  0
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M  END
>  <Mol_ID> (31)
31

>  <Formula> (31)
C16H31NaO4

>  <MolWeight> (31)
310.40471

>  <Cat> (31)
S1703

>  <Name> (31)
Divalproex Sodium

>  <Synonyms> (31)
N/A

>  <Target> (31)
HDAC

>  <Form> (31)
Sodium Salt

>  <CAS> (31)
76584-70-8

>  <URL> (31)
http://selleckchem.com/products/Divalproex-sodium.html

$$$$
PCI-34051.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (32)
32

>  <Formula> (32)
C17H16N2O3

>  <MolWeight> (32)
296.32054

>  <Cat> (32)
S2012

>  <Name> (32)
PCI-34051

>  <Synonyms> (32)
N/A

>  <Target> (32)
Apoptosis related,HDAC

>  <Form> (32)
free base

>  <CAS> (32)
950762-95-5

>  <URL> (32)
http://selleckchem.com/products/pci-34051.html

$$$$
CUDC-907.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (33)
33

>  <Formula> (33)
C23H24N8O4S

>  <MolWeight> (33)
508.55286

>  <Cat> (33)
S2759

>  <Name> (33)
Fimepinostat (CUDC-907)

>  <Synonyms> (33)
N/A

>  <Target> (33)
Apoptosis related,HDAC,PI3K

>  <Form> (33)
free base

>  <CAS> (33)
1339928-25-4

>  <URL> (33)
http://selleckchem.com/products/pi3k-hdac-inhibitor-i.html

$$$$
M344.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (34)
34

>  <Formula> (34)
C16H25N3O3

>  <MolWeight> (34)
307.388

>  <Cat> (34)
S2779

>  <Name> (34)
M344

>  <Synonyms> (34)
N/A

>  <Target> (34)
HDAC

>  <Form> (34)
free base

>  <CAS> (34)
251456-60-7

>  <URL> (34)
http://selleckchem.com/products/m344.html

$$$$
Bufexamac.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (35)
35

>  <Formula> (35)
C12H17NO3

>  <MolWeight> (35)
223.26828

>  <Cat> (35)
S3023

>  <Name> (35)
Bufexamac

>  <Synonyms> (35)
Bufexamic acid

>  <Target> (35)
COX,IFN

>  <Form> (35)
free base

>  <CAS> (35)
2438-72-4

>  <URL> (35)
http://selleckchem.com/products/bufexamac.html

$$$$
Sirtinol.cdx
csChFnd80/07292609462D

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  5  6  2  0  0  0  0
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  2  7  2  0  0  0  0
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M  END
>  <Mol_ID> (36)
36

>  <Formula> (36)
C26H22N2O2

>  <MolWeight> (36)
394.46508

>  <Cat> (36)
S2804

>  <Name> (36)
Sirtinol

>  <Synonyms> (36)
N/A

>  <Target> (36)
Sirtuin

>  <Form> (36)
free base

>  <CAS> (36)
410536-97-9

>  <URL> (36)
http://selleckchem.com/products/sirtinol.html

$$$$
CI994.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (37)
37

>  <Formula> (37)
C15H15N3O2

>  <MolWeight> (37)
269.2985

>  <Cat> (37)
S2818

>  <Name> (37)
Tacedinaline (CI994)

>  <Synonyms> (37)
PD-123654, GOE-5549, Acetyldinaline

>  <Target> (37)
HDAC

>  <Form> (37)
free base

>  <CAS> (37)
112522-64-2

>  <URL> (37)
http://selleckchem.com/products/ci994-tacedinaline.html

$$$$
Quercetin.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (38)
38

>  <Formula> (38)
C15H10O7

>  <MolWeight> (38)
302.2357

>  <Cat> (38)
S2391

>  <Name> (38)
Quercetin (NSC 9221)

>  <Synonyms> (38)
Sophoretin, C.I. 75720

>  <Target> (38)
Apoptosis related,Autophagy,Mitophagy,PI3K,PKC,Sirtuin,Src

>  <Form> (38)
Free Base

>  <CAS> (38)
117-39-5

>  <URL> (38)
http://selleckchem.com/products/Quercetin(Sophoretin).html

$$$$
KW2449.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (39)
39

>  <Formula> (39)
C20H20N4O

>  <MolWeight> (39)
332.399

>  <Cat> (39)
S2158

>  <Name> (39)
KW-2449

>  <Synonyms> (39)
N/A

>  <Target> (39)
Aurora Kinase,Bcr-Abl,FLT3

>  <Form> (39)
free base

>  <CAS> (39)
1000669-72-6

>  <URL> (39)
http://selleckchem.com/products/KW-2449.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (40)
40

>  <Formula> (40)
C24H30ClN3O5

>  <MolWeight> (40)
475.9651

>  <Cat> (40)
S2170

>  <Name> (40)
Givinostat (ITF2357)

>  <Synonyms> (40)
N/A

>  <Target> (40)
HDAC

>  <Form> (40)
Chloride

>  <CAS> (40)
732302-99-7

>  <URL> (40)
http://selleckchem.com/products/ITF2357(Givinostat).html

$$$$
Fisetin.cdx
csChFnd80/07292609462D

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   10.8993    6.2903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8993    3.4951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  2  1  0  0  0  0
  4 11  1  0  0  0  0
  7 12  2  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 14  1  0  0  0  0
 17 20  1  0  0  0  0
 16 21  1  0  0  0  0
M  END
>  <Mol_ID> (41)
41

>  <Formula> (41)
C15H10O6

>  <MolWeight> (41)
286.2363

>  <Cat> (41)
S2298

>  <Name> (41)
Fisetin

>  <Synonyms> (41)
N/A

>  <Target> (41)
Sirtuin

>  <Form> (41)
free base

>  <CAS> (41)
528-48-3

>  <URL> (41)
http://selleckchem.com/products/Fisetin(Fustel).html

$$$$
Parthenolide.cdx
csChFnd80/07292609462D

 18 20  0  0  0  0  0  0  0  0999 V2000
    0.0000    4.8240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.4240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.7240    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4249    3.4240    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4249    4.8240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    5.5240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.7240    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.8497    3.4240    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8497    4.8240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.5240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9284    1.3546    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3207    1.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8901    2.4872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.2240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2548    2.7773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0183    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.0240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5149    1.5157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  1  6  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
  8 13  1  1  0  0  0
  5 14  1  0  0  0  0
 13 15  2  0  0  0  0
 12 16  2  0  0  0  0
  3 17  1  0  0  0  0
  4 17  1  1  0  0  0
  3 18  1  1  0  0  0
M  END
>  <Mol_ID> (42)
42

>  <Formula> (42)
C15H20O3

>  <MolWeight> (42)
248.3175

>  <Cat> (42)
S2341

>  <Name> (42)
(-)-Parthenolide

>  <Synonyms> (42)
N/A

>  <Target> (42)
HDAC,MDM2/MDMX,NF-¦ÊB,p53

>  <Form> (42)
free base

>  <CAS> (42)
20554-84-1

>  <URL> (42)
http://selleckchem.com/products/Parthenolide((-)-Parthenolide).html

$$$$
Quercetin dihydrate.cdx
csChFnd80/07292609462D

 24 24  0  0  0  0  0  0  0  0999 V2000
    1.2082    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    4.1951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    1.3976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    7.6879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8993    6.2903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1496    3.8440    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7497    3.8440    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
  3 12  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 15  1  0  0  0  0
 19 21  1  0  0  0  0
 18 22  1  0  0  0  0
M  END
>  <Mol_ID> (43)
43

>  <Formula> (43)
C15H14O9

>  <MolWeight> (43)
338.26626

>  <Cat> (43)
S2347

>  <Name> (43)
Quercetin Dihydrate

>  <Synonyms> (43)
Sophoretin

>  <Target> (43)
PI3K,Sirtuin

>  <Form> (43)
Dihydrate

>  <CAS> (43)
6151-25-3

>  <URL> (43)
http://selleckchem.com/products/Quercetin-dihydrate(Sophoretin).html

$$$$
TAK-901.cdx
csChFnd80/07292609462D

 36 40  0  0  0  0  0  0  0  0999 V2000
    1.2082    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    2.7976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4702    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4702    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8909    9.0903    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.1033    9.7903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1933   10.2985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5884    7.8821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3115    9.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0141    2.3649    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8370    3.4976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0141    4.6302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2294    3.6439    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.7988    4.9229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9759    6.0555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5836    5.9092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
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 23 18  1  0  0  0  0
 20 24  1  0  0  0  0
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 24 26  2  0  0  0  0
 24 27  2  0  0  0  0
 25 28  1  0  0  0  0
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 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 14  1  0  0  0  0
 30 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 34  1  0  0  0  0
 34 35  2  0  0  0  0
 35 31  1  0  0  0  0
 34 36  1  0  0  0  0
M  END
>  <Mol_ID> (44)
44

>  <Formula> (44)
C28H32N4O3S

>  <MolWeight> (44)
504.64368

>  <Cat> (44)
S2718

>  <Name> (44)
TAK-901

>  <Synonyms> (44)
N/A

>  <Target> (44)
Aurora Kinase

>  <Form> (44)
free base

>  <CAS> (44)
934541-31-8

>  <URL> (44)
http://selleckchem.com/products/tak-901.html

$$$$
AMG900.cdx
csChFnd80/07292609462D

 37 42  0  0  0  0  0  0  0  0999 V2000
    1.2082    6.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    4.8951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6784    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8909    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1033    2.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5240    4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6703    2.8052    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   16.0397    2.5142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 34 37  1  0  0  0  0
M  END
>  <Mol_ID> (45)
45

>  <Formula> (45)
C28H21N7OS

>  <MolWeight> (45)
503.57764

>  <Cat> (45)
S2719

>  <Name> (45)
AMG-900

>  <Synonyms> (45)
N/A

>  <Target> (45)
Aurora Kinase

>  <Form> (45)
free base

>  <CAS> (45)
945595-80-2

>  <URL> (45)
http://selleckchem.com/products/amg-900.html

$$$$
Curcumin.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (46)
46

>  <Formula> (46)
C21H20O6

>  <MolWeight> (46)
368.3799

>  <Cat> (46)
S1848

>  <Name> (46)
Curcumin

>  <Synonyms> (46)
Diferuloylmethane, Natural Yellow 3, Turmeric yellow

>  <Target> (46)
Apoptosis related,Autophagy,Epigenetic Reader Domain,Ferroptosis,HCV,HDAC,Histone Acetyltransferase,HIV,Influenza Virus,NF-¦ÊB,Nrf2

>  <Form> (46)
free base

>  <CAS> (46)
458-37-7

>  <URL> (46)
http://selleckchem.com/products/Curcumin.html

$$$$
ICG001.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (47)
47

>  <Formula> (47)
C33H32N4O4

>  <MolWeight> (47)
548.63158

>  <Cat> (47)
S2662

>  <Name> (47)
Foscenvivint (ICG-001)

>  <Synonyms> (47)
N/A

>  <Target> (47)
Apoptosis related,Epigenetic Reader Domain,Wnt/beta-catenin

>  <Form> (47)
free base

>  <CAS> (47)
780757-88-2 (relative stereochemistry); 847591-62-2 (absolute stereochemistry)

>  <URL> (47)
http://selleckchem.com/products/icg-001.html

$$$$
GSK1070916.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (48)
48

>  <Formula> (48)
C30H33N7O

>  <MolWeight> (48)
507.62932

>  <Cat> (48)
S2740

>  <Name> (48)
GSK1070916

>  <Synonyms> (48)
N/A

>  <Target> (48)
Aurora Kinase

>  <Form> (48)
free base

>  <CAS> (48)
942918-07-2

>  <URL> (48)
http://selleckchem.com/products/gsk1070916.html

$$$$
MK-5108.cdx
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    0.0000    6.9903    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12  8  2  0  0  0  0
  6 13  1  0  0  0  0
 14 13  1  6  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 14  1  0  0  0  0
 14 20  1  1  0  0  0
 17 23  1  6  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 24  1  0  0  0  0
 25 30  1  0  0  0  0
 26 31  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (49)
49

>  <Formula> (49)
C22H21ClFN3O3S

>  <MolWeight> (49)
461.9368432

>  <Cat> (49)
S2770

>  <Name> (49)
MK-5108 (VX-689)

>  <Synonyms> (49)
N/A

>  <Target> (49)
Aurora Kinase,Autophagy

>  <Form> (49)
free base

>  <CAS> (49)
1010085-13-8

>  <URL> (49)
http://selleckchem.com/products/mk-5108-vx-689.html

$$$$
Tubastatin A hydrochloride.cdx
csChFnd80/07292609462D

 26 28  0  0  0  0  0  0  0  0999 V2000
    3.6247    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6247    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371    1.3927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.0927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.3951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    4.1903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    5.5903    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3904    6.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9578    7.7447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5578    7.7447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1252    6.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6210    8.7851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2516    8.4940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8190    7.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7557    6.1221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7598    6.1221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6966    7.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2640    8.4940    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8946    8.7851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1975    9.5308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4157    1.0573    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  7 10  2  0  0  0  0
  5 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 12  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 16  1  0  0  0  0
 13 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 14  1  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (50)
50

>  <Formula> (50)
C20H22ClN3O2

>  <MolWeight> (50)
371.86058

>  <Cat> (50)
S2627

>  <Name> (50)
Tubastatin A HCl

>  <Synonyms> (50)
TSA HCl

>  <Target> (50)
HDAC

>  <Form> (50)
Hydrochloride

>  <CAS> (50)
1310693-92-5

>  <URL> (50)
http://selleckchem.com/products/tubastatin-a-hcl.html

$$$$
PF-06405761.cdx
csChFnd80/07292609462D

 24 26  0  0  0  0  0  0  0  0999 V2000
    5.7386    1.5893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4398    0.3713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8421    0.3710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4353    2.8012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8353    2.8071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5440    1.5911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9437    1.5968    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.6452    2.8177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9347    4.0327    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5263    4.0287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0438    2.8177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6340    5.2439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3400    1.5893    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6408    2.8004    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.8519    3.4996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9415    4.0116    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4295    2.1010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2158    2.8071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0003    2.1060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2242    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4336    0.7051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2158    4.2057    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0046    4.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  6  2  0  0  0  0
  5  4  2  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  8 11  2  0  0  0  0
  9 12  1  0  0  0  0
  1 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  2  0  0  0  0
 14 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 17  1  0  0  0  0
 18 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (51)
51

>  <Formula> (51)
C16H17N3O4S

>  <MolWeight> (51)
347.38888

>  <Cat> (51)
S1216

>  <Name> (51)
PFI-1 (PF-6405761)

>  <Synonyms> (51)
N/A

>  <Target> (51)
Epigenetic Reader Domain

>  <Form> (51)
free base

>  <CAS> (51)
1403764-72-6

>  <URL> (51)
http://selleckchem.com/products/pfl-1.html

$$$$
Tolcapone.cdx
csChFnd80/07292609462D

 20 21  0  0  0  0  0  0  0  0999 V2000
    4.8497    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    9.6995    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  2  0  0  0  0
  5 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 11  2  0  0  0  0
  9 14  1  0  0  0  0
 10 15  2  0  0  0  0
 11 16  1  0  0  0  0
 12 17  2  0  0  0  0
 12 18  1  0  0  0  0
 14 19  2  0  0  0  0
 15 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (52)
52

>  <Formula> (52)
C14H11NO5

>  <MolWeight> (52)
273.24084

>  <Cat> (52)
S4021

>  <Name> (52)
Tolcapone

>  <Synonyms> (52)
Ro 40-7592

>  <Target> (52)
COMT,Histone Methyltransferase,Transferase

>  <Form> (52)
free base

>  <CAS> (52)
134308-13-7

>  <URL> (52)
http://selleckchem.com/products/tolcapone.html

$$$$
sodium phenylbutyrate.cdx
csChFnd80/07292609462D

 13 13  0  0  0  0  0  0  0  0999 V2000
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 Na  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  1  5  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
  6 11  2  0  0  0  0
  4  6  1  0  0  0  0
  1 12  1  0  0  0  0
 12 13  1  0  0  0  0
M  END
>  <Mol_ID> (53)
53

>  <Formula> (53)
C10H11NaO2

>  <MolWeight> (53)
186.18291

>  <Cat> (53)
S4125

>  <Name> (53)
Sodium Phenylbutyrate

>  <Synonyms> (53)
4-PBA, 4-Phenylbutyric acid, NaPB

>  <Target> (53)
HDAC

>  <Form> (53)
Sodium Salt

>  <CAS> (53)
1716-12-7

>  <URL> (53)
http://selleckchem.com/products/sodium-phenylbutyrate.html

$$$$
4SC-201(resminostat,BYK408740).cdx
csChFnd80/07292609462D

 24 25  0  0  0  0  0  0  0  0999 V2000
    2.4207    9.1971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    7.7971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    7.0971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    7.7971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    9.1971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    9.8971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0538    9.8947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    9.1947    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    7.7995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4744    9.8922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    7.0995    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    5.6995    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.7995    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.3995    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0798    4.8766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5124    3.5451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9124    3.5451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3451    4.8766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7325    2.4165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1325    2.4165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8300    1.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2252    1.2082    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1325    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9228    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  2 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 11 14  2  0  0  0  0
 12 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 12  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  1  0  0  0  0
M  END
>  <Mol_ID> (54)
54

>  <Formula> (54)
C16H19N3O4S

>  <MolWeight> (54)
349.40476

>  <Cat> (54)
S2693

>  <Name> (54)
Resminostat

>  <Synonyms> (54)
RAS2410

>  <Target> (54)
HDAC

>  <Form> (54)
free base

>  <CAS> (54)
864814-88-0

>  <URL> (54)
http://selleckchem.com/products/resminostat-ras2410.html

$$$$
Tenovin-6 HCl.cdx
csChFnd80/07292609462D

 33 33  0  0  0  0  0  0  0  0999 V2000
    6.0706    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    3.5049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6415    4.2073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.5049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6415    1.3976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0706    5.6049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2831    3.5049    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4955    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7079    3.5049    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4955    5.6049    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.9204    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1370    3.5024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3537    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3537    5.6098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1370    6.3122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9204    5.6098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5661    6.3098    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7786    5.6098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9910    6.3098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2034    5.6098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4159    6.3098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6283    5.6098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7786    4.2098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8407    6.3098    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.0532    5.6098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8407    7.7098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8528    1.3085    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  2  7  2  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 13 18  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 20 25  2  0  0  0  0
 19 20  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 24 26  1  0  0  0  0
 16 19  1  0  0  0  0
 11 13  1  0  0  0  0
  9 10  1  0  0  0  0
  5 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 29 32  1  0  0  0  0
M  END
>  <Mol_ID> (55)
55

>  <Formula> (55)
C25H35ClN4O2S

>  <MolWeight> (55)
491.089

>  <Cat> (55)
S4900

>  <Name> (55)
Tenovin-6

>  <Synonyms> (55)
N/A

>  <Target> (55)
Dehydrogenase,p53,Sirtuin

>  <Form> (55)
free base

>  <CAS> (55)
1011557-82-6

>  <URL> (55)
http://selleckchem.com/products/tenovin-6.html

$$$$
ENMD-2076 L-(+)-Tartaric acid.cdx
csChFnd80/07292609462D

 38 40  0  0  0  0  0  0  0  0999 V2000
    3.5666   10.9845    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455   11.5540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6992   12.9463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3298   13.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6298   12.0249    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0538   10.8564    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0538    9.4613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    8.7613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    7.3613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0538    6.6613    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    7.3613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7623   14.5119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    6.6637    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    7.3637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    6.6637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    5.2637    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4744    6.6637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.3842    1.3976    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    3.7553    2.0927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9635    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5924    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8006    1.3976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  2  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
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 12  7  1  0  0  0  0
  4 13  1  0  0  0  0
  9 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 14  1  0  0  0  0
 17 20  1  0  0  0  0
 11 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
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 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 23  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
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 29 33  1  0  0  0  0
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 31 35  1  0  0  0  0
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 35 37  2  0  0  0  0
 31 38  1  6  0  0  0
M  END
>  <Mol_ID> (56)
56

>  <Formula> (56)
C25H31N7O6

>  <MolWeight> (56)
525.55694

>  <Cat> (56)
S2018

>  <Name> (56)
ENMD-2076 L-(+)-Tartaric acid

>  <Synonyms> (56)
N/A

>  <Target> (56)
Aurora Kinase,FLT3,VEGFR

>  <Form> (56)
free base

>  <CAS> (56)
1291074-87-7

>  <URL> (56)
http://selleckchem.com/products/enmd-2076-l-tartaric-acid.html

$$$$
S1096-JNJ26481585.cdx
csChFnd80/07292609462D

 31 32  0  0  0  0  0  0  0  0999 V2000
    8.4322    8.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4422    7.0247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8046    5.6724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1569    5.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1468    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7845    7.6523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7924    4.0626    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1752    4.2816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3942    5.6644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1569    2.8152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6416    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8541    5.6000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.0665    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2789    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2789    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4914    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7038    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  5  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 14  1  0  0  0  0
 17 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 20  1  0  0  0  0
 23 26  1  0  0  0  0
 26 27  2  0  0  0  0
 26 28  1  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (57)
57

>  <Formula> (57)
C21H28Cl2N6O2

>  <MolWeight> (57)
467.39202

>  <Cat> (57)
S1096

>  <Name> (57)
Quisinostat (JNJ-26481585) 2HCl

>  <Synonyms> (57)
N/A

>  <Target> (57)
HDAC

>  <Form> (57)
Dihydrochloride

>  <CAS> (57)
875320-31-3

>  <URL> (57)
http://selleckchem.com/products/JNJ-26481585.html

$$$$

csChFnd80/07292609462D

 29 27  0  0  0  0  0  0  0  0999 V2000
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   19.1676    2.0842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7516    2.0831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.7516    0.6888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  2  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 10 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 14 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (58)
58

>  <Formula> (58)
C20H28Cl3N3O3

>  <MolWeight> (58)
464.81362

>  <Cat> (58)
S4589

>  <Name> (58)
Amodiaquine dihydrochloride dihydrate

>  <Synonyms> (58)
N/A

>  <Target> (58)
Histone Methyltransferase,HNMT,Transferase

>  <Form> (58)
dihydrochloride dihydrate

>  <CAS> (58)
6398-98-7

>  <URL> (58)
http://selleckchem.com/products/amodiaquine-dihydrochloride-dihydrate.html

$$$$

csChFnd80/07292609462D

 49 50  0  0  0  0  0  0  0  0999 V2000
    7.5197    4.8341    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   10.2978    4.8341    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    5.8341    8.9643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6124    8.9643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3904    8.9643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9266    7.2604    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9266    3.0745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1859    2.4635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6671    2.4635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9266    4.4637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5008    1.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3521    1.1113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2046    3.4265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6298    3.4080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6303    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2227    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8343    0.6852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0372    0.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7226    5.1489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1304    5.1489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5567    3.0190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2963    2.9821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8715    1.6484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.6114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7226    6.5565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1304    6.5565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9266    8.6495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5761    7.2604    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5761    3.0745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3168    2.4635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8356    2.4635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5761    4.4637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0019    1.1113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1504    1.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8543    3.4265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2797    3.4080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2800    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8724    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4840    0.6852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6869    0.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3723    5.1489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7801    5.1489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2064    3.0190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9460    2.9821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5212    1.6484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6497    1.6114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3723    6.5565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7801    6.5565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5761    8.6495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  6 25  1  0  0  0  0
  6 26  1  0  0  0  0
  6 27  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  2  0  0  0  0
  8 11  1  0  0  0  0
  8 13  2  0  0  0  0
  9 12  1  0  0  0  0
  9 14  2  0  0  0  0
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
 11 15  1  0  0  0  0
 11 17  2  0  0  0  0
 12 16  1  0  0  0  0
 12 18  2  0  0  0  0
 13 21  1  0  0  0  0
 14 22  1  0  0  0  0
 15 16  2  0  0  0  0
 17 23  1  0  0  0  0
 18 24  1  0  0  0  0
 19 25  1  0  0  0  0
 20 26  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
 28 47  1  0  0  0  0
 28 48  1  0  0  0  0
 28 49  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 29 32  2  0  0  0  0
 30 33  1  0  0  0  0
 30 36  2  0  0  0  0
 31 34  1  0  0  0  0
 31 35  2  0  0  0  0
 32 41  1  0  0  0  0
 32 42  1  0  0  0  0
 33 38  1  0  0  0  0
 33 40  2  0  0  0  0
 34 37  1  0  0  0  0
 34 39  2  0  0  0  0
 35 43  1  0  0  0  0
 36 44  1  0  0  0  0
 37 38  2  0  0  0  0
 39 45  1  0  0  0  0
 40 46  1  0  0  0  0
 41 47  1  0  0  0  0
 42 48  1  0  0  0  0
 43 45  2  0  0  0  0
 44 46  2  0  0  0  0
M  END
>  <Mol_ID> (59)
59

>  <Formula> (59)
C42H50Cl2N2O3

>  <MolWeight> (59)
701.764

>  <Cat> (59)
S4635

>  <Name> (59)
Cyproheptadine hydrochloride sesquihydrate

>  <Synonyms> (59)
Periactin hydrochloride, Peritol

>  <Target> (59)
5-HT Receptor,SETD

>  <Form> (59)
hydrochloride sesquihydrate

>  <CAS> (59)
41354-29-4

>  <URL> (59)
https://www.selleckchem.com/products/cyproheptadine-hydrochloride-sesquihydrate.html

$$$$
S4735 Salvianolic acid B.cdx
csChFnd80/07292609462D

 52 56  0  0  0  0  0  0  0  0999 V2000
   10.9455    3.5183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2911    3.9469    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.9455    2.1066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7221    4.2247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1128    2.8021    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.7306    5.2762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2825    1.6712    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7216    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5039    3.5213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7221    5.6247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5127    2.8021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1015    5.5601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7406    6.2661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4990    2.1058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7216    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5096    6.3247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2033    1.5915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2082    4.0038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5410    6.8893    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.5096    7.7247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5927    1.5930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6010    4.0038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9119    7.1733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5510    7.8793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2972    8.4247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7221    8.4247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2894    2.7921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2927    0.3805    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3514    8.5025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9134    9.2316    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1988    7.5169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0848    7.7247    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   18.6894    2.7921    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7092    8.7261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3860    9.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8723    8.4247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0848    6.3247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1883   10.0380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8594   10.8716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6599    7.7247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8723    5.6247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2972    5.6247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2586   11.1376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5667   10.2829    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6599    6.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4399    8.4290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7261   12.4573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4346    5.6049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2178    7.7234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    6.3112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4346    4.2049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.6112    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  6  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  1  0  0  0
  5  7  1  0  0  0  0
  6 12  1  0  0  0  0
  6 13  2  0  0  0  0
  8 14  2  0  0  0  0
  8 15  1  0  0  0  0
  9 14  1  0  0  0  0
 10 16  2  0  0  0  0
 11 17  1  0  0  0  0
 11 18  2  0  0  0  0
 12 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  2  0  0  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
 19 24  1  1  0  0  0
 20 25  1  0  0  0  0
 20 26  2  0  0  0  0
 21 27  1  0  0  0  0
 21 28  1  0  0  0  0
 22 27  2  0  0  0  0
 23 29  1  0  0  0  0
 24 30  1  0  0  0  0
 24 31  2  0  0  0  0
 32 25  1  0  0  0  0
 27 33  1  0  0  0  0
 29 34  1  0  0  0  0
 29 35  2  0  0  0  0
 32 36  1  0  0  0  0
 32 37  1  1  0  0  0
 34 38  2  0  0  0  0
 35 39  1  0  0  0  0
 36 40  1  0  0  0  0
 37 41  1  0  0  0  0
 37 42  2  0  0  0  0
 38 43  1  0  0  0  0
 38 44  1  0  0  0  0
 39 43  2  0  0  0  0
 40 45  2  0  0  0  0
 40 46  1  0  0  0  0
 43 47  1  0  0  0  0
 45 48  1  0  0  0  0
 46 49  2  0  0  0  0
 48 50  2  0  0  0  0
 48 51  1  0  0  0  0
 49 50  1  0  0  0  0
 50 52  1  0  0  0  0
M  END
>  <Mol_ID> (60)
60

>  <Formula> (60)
C36H30O16

>  <MolWeight> (60)
718.6138

>  <Cat> (60)
S4735

>  <Name> (60)
Salvianolic acid B

>  <Synonyms> (60)
Sal B, Lithospermate B, Lithospermic acid B

>  <Target> (60)
Sirtuin

>  <Form> (60)
free base

>  <CAS> (60)
121521-90-2

>  <URL> (60)
http://selleckchem.com/products/salvianolic-acid-b.html

$$$$
S3981 Sinapinic Acid.cdx
csChFnd80/07292609462D

 16 16  0  0  0  0  0  0  0  0999 V2000
    1.2131    4.1786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.7987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4275    4.8822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0007    4.8786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4153    2.0993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0987    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6446    4.1776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0007    6.2781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6392    2.8004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4153    0.6993    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8571    4.8776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6264    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0706    4.1769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2643    4.8661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4487    4.1823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2643    6.2982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  2  0  0  0  0
  5 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7  9  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
M  END
>  <Mol_ID> (61)
61

>  <Formula> (61)
C11H12O5

>  <MolWeight> (61)
224.20998

>  <Cat> (61)
S3981

>  <Name> (61)
Sinapinic Acid

>  <Synonyms> (61)
Sinapic acid

>  <Target> (61)
ACE,HDAC

>  <Form> (61)
free base

>  <CAS> (61)
530-59-6

>  <URL> (61)
http://selleckchem.com/products/sinapinic-acid.html

$$$$
S3984 Nordihydroguaiaretic acid.cdx
csChFnd80/07292609462D

 22 23  0  0  0  0  0  0  0  0999 V2000
    8.5458    2.8429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3334    2.1429    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.1209    2.8429    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.9085    2.1429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1209    4.2429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3334    0.7429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6961    2.8429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3627    2.0803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.7935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2298    4.2027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5137    4.8860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6909    4.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0173    4.9027    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0935    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7582    2.1429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9749    2.8453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2155    2.0977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (62)
62

>  <Formula> (62)
C18H22O4

>  <MolWeight> (62)
302.36488

>  <Cat> (62)
S3984

>  <Name> (62)
Nordihydroguaiaretic acid (NDGA)

>  <Synonyms> (62)
N/A

>  <Target> (62)
Apoptosis related,Autophagy,Epigenetic Reader Domain,Ferroptosis,HER2,IGF-1R,Lipoxygenase

>  <Form> (62)
free base

>  <CAS> (62)
500-38-9

>  <URL> (62)
http://selleckchem.com/products/nordihydroguaiaretic-acid.html

$$$$
S3781 Ginkgolide C.cdx
csChFnd80/07292609462D

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 10  9  1  0  0  0  0
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 14 10  1  0  0  0  0
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M  END
>  <Mol_ID> (63)
63

>  <Formula> (63)
C20H24O11

>  <MolWeight> (63)
440.39796

>  <Cat> (63)
S3781

>  <Name> (63)
Ginkgolide C

>  <Synonyms> (63)
BN-52022

>  <Target> (63)
MMP

>  <Form> (63)
free base

>  <CAS> (63)
15291-76-6

>  <URL> (63)
http://selleckchem.com/products/ginkgolide-c.html

$$$$
Scriptaid (GCK 1026).cdx
csChFnd80/07292609462D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (64)
64

>  <Formula> (64)
C18H18N2O4

>  <MolWeight> (64)
326.34652

>  <Cat> (64)
S8043

>  <Name> (64)
Scriptaid

>  <Synonyms> (64)
GCK 1026

>  <Target> (64)
HDAC

>  <Form> (64)
free base

>  <CAS> (64)
287383-59-9

>  <URL> (64)
http://selleckchem.com/products/scriptaid.html

$$$$
EPZ004777.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (65)
65

>  <Formula> (65)
C28H41N7O4

>  <MolWeight> (65)
539.66964

>  <Cat> (65)
S7353

>  <Name> (65)
EPZ004777

>  <Synonyms> (65)
N/A

>  <Target> (65)
Apoptosis related,DOT1,Histone Methyltransferase

>  <Form> (65)
free base

>  <CAS> (65)
1338466-77-5

>  <URL> (65)
http://selleckchem.com/products/epz004777.html

$$$$
S3898 Hydroxy Camptothecine.cdx
csChFnd80/07292609462D

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   10.1416    0.3180    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  6  0  0  0
  3  9  1  1  0  0  0
  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  5 12  2  0  0  0  0
  6 13  1  0  0  0  0
  7 14  2  0  0  0  0
  7 13  1  0  0  0  0
  8 15  1  0  0  0  0
 10 16  1  0  0  0  0
 10 11  1  0  0  0  0
 11 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  2  0  0  0  0
 17 18  1  0  0  0  0
 18 20  2  0  0  0  0
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 21 23  1  0  0  0  0
 21 22  2  0  0  0  0
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 23 25  2  0  0  0  0
 24 26  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (66)
66

>  <Formula> (66)
C20H16N2O5

>  <MolWeight> (66)
364.35144

>  <Cat> (66)
S3898

>  <Name> (66)
Hydroxy Camptothecine

>  <Synonyms> (66)
10-Hydroxycamptothecin, Hydroxycamptothecine

>  <Target> (66)
Topoisomerase

>  <Form> (66)
free base

>  <CAS> (66)
64439-81-2

>  <URL> (66)
http://selleckchem.com/products/hydroxy-camptothecine.html

$$$$
Sodium valproate.cdx
csChFnd80/07292609462D

 11 10  0  0  0  0  0  0  0  0999 V2000
    0.0000    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  2  0  0  0  0
  4  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  6  7  1  0  0  0  0
M  END
>  <Mol_ID> (67)
67

>  <Formula> (67)
C8H15NaO2

>  <MolWeight> (67)
166.19327

>  <Cat> (67)
S1168

>  <Name> (67)
Valproic Acid (NSC 93819) sodium salt

>  <Synonyms> (67)
Sodium valproate,NSC 93819,2-Propylpentanoic Acid

>  <Target> (67)
Autophagy,GABA Receptor,HDAC,Mitophagy,Notch,PGC-1¦Á

>  <Form> (67)
Sodium salt

>  <CAS> (67)
1069-66-5

>  <URL> (67)
http://selleckchem.com/products/Sodium-valproate.html

$$$$
SNS-314 Mesylate.cdx
csChFnd80/07292609462D

 33 35  0  0  0  0  0  0  0  0999 V2000
    2.1148    5.3083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1148    3.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3272    3.2083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5397    3.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5397    5.3083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3272    6.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7625    5.6707    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.4965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8810    3.4085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3272    7.4035    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5355    8.1010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7437    7.4035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9519    8.1010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2309    7.5316    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    9.1677    8.5720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4677    9.7845    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0982    9.4934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5552    8.4262    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5101    7.0058    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.3026    6.0230    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3560    8.1153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7446    7.9369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5934    9.0502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0536   10.3420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6650   10.5204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8162    9.4071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9771    8.8724    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   10.7283    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1283    1.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.1283    2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   13.5283    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  2  1  0  0  0  0
  6 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 13  2  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 22  1  0  0  0  0
 24 28  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  2  0  0  0  0
 30 33  1  0  0  0  0
M  END
>  <Mol_ID> (68)
68

>  <Formula> (68)
C19H19ClN6O4S3

>  <MolWeight> (68)
527.03996

>  <Cat> (68)
S1154

>  <Name> (68)
SNS-314

>  <Synonyms> (68)
N/A

>  <Target> (68)
Aurora Kinase

>  <Form> (68)
Mesylate

>  <CAS> (68)
1057249-41-8

>  <URL> (68)
http://selleckchem.com/products/sns-314-mesylate.html

$$$$
ACY-1215.cdx
csChFnd80/07292609462D

 32 34  0  0  0  0  0  0  0  0999 V2000
    0.0000    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.3927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    4.1903    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    5.5854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    6.2854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    7.6854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    8.3854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    7.6854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    6.2854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    2.0927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0538    1.3927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0538    4.1927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4744    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4744    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827    2.0927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.8909    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0991    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3073    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5156    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7238    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9320    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1403    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3485    2.0927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.5609    1.3927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1403    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14  8  1  0  0  0  0
  9 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19  9  1  0  0  0  0
 17 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 32  2  0  0  0  0
 30 31  1  0  0  0  0
M  END
>  <Mol_ID> (69)
69

>  <Formula> (69)
C24H27N5O3

>  <MolWeight> (69)
433.50288

>  <Cat> (69)
S8001

>  <Name> (69)
Ricolinostat (ACY-1215)

>  <Synonyms> (69)
Rocilinostat

>  <Target> (69)
Apoptosis related,HDAC

>  <Form> (69)
free base

>  <CAS> (69)
1316214-52-4

>  <URL> (69)
http://selleckchem.com/products/rocilinostat-acy-1215.html

$$$$
Tenovin-1.cdx
csChFnd80/07292609462D

 26 27  0  0  0  0  0  0  0  0999 V2000
    2.4291    3.5049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4291    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6458    1.3976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8624    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8624    3.5049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6458    4.2073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2167    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0042    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2167    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.6976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0748    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2873    3.5049    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4997    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7121    3.5049    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9246    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0748    5.6049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4997    5.6049    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.1412    3.5024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3579    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3579    5.6097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1412    6.3122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9246    5.6097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5703    6.3097    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7828    5.6097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9952    6.3097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7828    4.2098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  1  0  0  0  0
  5 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 11 16  2  0  0  0  0
 13 17  2  0  0  0  0
 15 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 15  1  0  0  0  0
 20 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  2  0  0  0  0
M  END
>  <Mol_ID> (70)
70

>  <Formula> (70)
C20H23N3O2S

>  <MolWeight> (70)
369.48052

>  <Cat> (70)
S8000

>  <Name> (70)
Tenovin-1

>  <Synonyms> (70)
N/A

>  <Target> (70)
Dehydrogenase,p53,Sirtuin

>  <Form> (70)
free base

>  <CAS> (70)
380315-80-0

>  <URL> (70)
http://selleckchem.com/products/tenovin-1.html

$$$$
(+)-JQ1.cdx
csChFnd80/07292609462D

 31 34  0  0  0  0  0  0  0  0999 V2000
    1.9352    9.3659    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3657    8.0846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4126    7.1451    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6212    7.8515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.5545    4.8440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.9213    7.2634    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0000    7.7927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9343    5.1715    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (71)
71

>  <Formula> (71)
C23H25ClN4O2S

>  <MolWeight> (71)
456.9882

>  <Cat> (71)
S7110

>  <Name> (71)
(+)-JQ1

>  <Synonyms> (71)
N/A

>  <Target> (71)
Autophagy,Epigenetic Reader Domain,NSD,Target Protein Ligand

>  <Form> (71)
free base

>  <CAS> (71)
1268524-70-4

>  <URL> (71)
http://selleckchem.com/products/jq1.html

$$$$
GSK J4 HCL.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (72)
72

>  <Formula> (72)
C24H28ClN5O2

>  <MolWeight> (72)
453.96442

>  <Cat> (72)
S7070

>  <Name> (72)
GSK J4 HCl (GSKJ4 HCl)

>  <Synonyms> (72)
N/A

>  <Target> (72)
Histone Demethylase,JMJD

>  <Form> (72)
Hydrochloride

>  <CAS> (72)
1797983-09-5

>  <URL> (72)
http://selleckchem.com/products/gsk-j4-hcl.html

$$$$
CCT129202.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (73)
73

>  <Formula> (73)
C23H25ClN8OS

>  <MolWeight> (73)
497.0156

>  <Cat> (73)
S1519

>  <Name> (73)
CCT129202

>  <Synonyms> (73)
N/A

>  <Target> (73)
Aurora Kinase

>  <Form> (73)
Free Base

>  <CAS> (73)
942947-93-5

>  <URL> (73)
http://selleckchem.com/products/CCT129202.html

$$$$
Sodium butyrate.cdx
csChFnd80/07292609462D

  7  5  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (74)
74

>  <Formula> (74)
C4H7NaO2

>  <MolWeight> (74)
110.08695

>  <Cat> (74)
S1999

>  <Name> (74)
Sodium butyrate

>  <Synonyms> (74)
NaB, Butanoic acid sodium salt

>  <Target> (74)
Apoptosis related,Autophagy,HDAC

>  <Form> (74)
Sodium Salt

>  <CAS> (74)
156-54-7

>  <URL> (74)
http://selleckchem.com/products/Sodium-butyrate.html

$$$$
CCT137690.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (75)
75

>  <Formula> (75)
C26H31BrN8O

>  <MolWeight> (75)
551.48134

>  <Cat> (75)
S2744

>  <Name> (75)
CCT137690

>  <Synonyms> (75)
N/A

>  <Target> (75)
Aurora Kinase

>  <Form> (75)
Free Base

>  <CAS> (75)
1095382-05-0

>  <URL> (75)
http://selleckchem.com/products/cct137690.html

$$$$
CPI-169.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (76)
76

>  <Formula> (76)
C27H36N4O5S

>  <MolWeight> (76)
528.66354

>  <Cat> (76)
S7616

>  <Name> (76)
CPI-169

>  <Synonyms> (76)
N/A

>  <Target> (76)
EZH1/2,Histone Methyltransferase

>  <Form> (76)
free base

>  <CAS> (76)
1450655-76-1

>  <URL> (76)
http://selleckchem.com/products/cpi-169.html

$$$$
AMI-1.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (77)
77

>  <Formula> (77)
C21H14N2Na2O9S2

>  <MolWeight> (77)
548.4534

>  <Cat> (77)
S7884

>  <Name> (77)
AMI-1

>  <Synonyms> (77)
N/A

>  <Target> (77)
Histone Methyltransferase,PRMT

>  <Form> (77)
disodium salt

>  <CAS> (77)
20324-87-2

>  <URL> (77)
http://selleckchem.com/products/ami-1.html

$$$$
GSK503.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (78)
78

>  <Formula> (78)
C31H38N6O2

>  <MolWeight> (78)
526.67242

>  <Cat> (78)
S7804

>  <Name> (78)
GSK503

>  <Synonyms> (78)
N/A

>  <Target> (78)
EZH1/2,Histone Methyltransferase

>  <Form> (78)
free base

>  <CAS> (78)
1346572-63-1

>  <URL> (78)
http://selleckchem.com/products/gsk503.html

$$$$
CPI-360.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (79)
79

>  <Formula> (79)
C25H31N3O4

>  <MolWeight> (79)
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>  <Cat> (79)
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>  <Name> (79)
CPI-360

>  <Synonyms> (79)
N/A

>  <Target> (79)
EZH1/2,Histone Methyltransferase

>  <Form> (79)
free base

>  <CAS> (79)
1802175-06-9

>  <URL> (79)
http://selleckchem.com/products/cpi-360.html

$$$$
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csChFnd80/07292609462D

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>  <Mol_ID> (80)
80

>  <Formula> (80)
C20H21NO4S

>  <MolWeight> (80)
371.45004

>  <Cat> (80)
S7231

>  <Name> (80)
GSK2801

>  <Synonyms> (80)
N/A

>  <Target> (80)
Epigenetic Reader Domain

>  <Form> (80)
free base

>  <CAS> (80)
1619994-68-1

>  <URL> (80)
http://selleckchem.com/products/gsk2801.html

$$$$
SirReal2.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (81)
81

>  <Formula> (81)
C22H20N4OS2

>  <MolWeight> (81)
420.5504

>  <Cat> (81)
S7845

>  <Name> (81)
SirReal2

>  <Synonyms> (81)
N/A

>  <Target> (81)
Sirtuin

>  <Form> (81)
free base

>  <CAS> (81)
709002-46-0

>  <URL> (81)
http://selleckchem.com/products/sirreal2.html

$$$$
CBL0137(CBL-0137).cdx
csChFnd80/07292609462D

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>  <Mol_ID> (82)
82

>  <Formula> (82)
C21H25ClN2O2

>  <MolWeight> (82)
372.8884

>  <Cat> (82)
S8483

>  <Name> (82)
CBL0137 HCl

>  <Synonyms> (82)
CBLC137 HCl, Curaxin 137 HCl

>  <Target> (82)
NF-¦ÊB,p53

>  <Form> (82)
HCl

>  <CAS> (82)
1197397-89-9

>  <URL> (82)
http://selleckchem.com/products/cbl0137-cbl-0137.html

$$$$
S3944 Valproic acid.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (83)
83

>  <Formula> (83)
C8H16O2

>  <MolWeight> (83)
144.21144

>  <Cat> (83)
S3944

>  <Name> (83)
Valproic acid (VPA)

>  <Synonyms> (83)
2-Propylvaleric Acid, Valproate

>  <Target> (83)
Autophagy,HDAC,Mitophagy,Notch,PGC-1¦Á

>  <Form> (83)
free base

>  <CAS> (83)
99-66-1

>  <URL> (83)
http://selleckchem.com/products/valproic-acid.html

$$$$
WT161.cdx
csChFnd80/07292609462D

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 14  9  1  0  0  0  0
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M  END
>  <Mol_ID> (84)
84

>  <Formula> (84)
C27H30N4O3

>  <MolWeight> (84)
458.5521

>  <Cat> (84)
S8495

>  <Name> (84)
WT161

>  <Synonyms> (84)
N/A

>  <Target> (84)
Apoptosis related,HDAC

>  <Form> (84)
free base

>  <CAS> (84)
1206731-57-8

>  <URL> (84)
http://selleckchem.com/products/wt161.html

$$$$
Bromosporine.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (85)
85

>  <Formula> (85)
C17H20N6O4S

>  <MolWeight> (85)
404.4435

>  <Cat> (85)
S7233

>  <Name> (85)
Bromosporine

>  <Synonyms> (85)
N/A

>  <Target> (85)
Epigenetic Reader Domain

>  <Form> (85)
free base

>  <CAS> (85)
1619994-69-2

>  <URL> (85)
http://selleckchem.com/products/bromosporine.html

$$$$
EPZ005687.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (86)
86

>  <Formula> (86)
C32H37N5O3

>  <MolWeight> (86)
539.66788

>  <Cat> (86)
S7004

>  <Name> (86)
EPZ005687

>  <Synonyms> (86)
N/A

>  <Target> (86)
EZH1/2,Histone Methyltransferase

>  <Form> (86)
Free Base

>  <CAS> (86)
1396772-26-1

>  <URL> (86)
http://selleckchem.com/products/epz005687.html

$$$$
GSK525762 (I-BET-762).cdx
csChFnd80/07292609462D

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    5.9828    8.5482    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (87)
87

>  <Formula> (87)
C22H22ClN5O2

>  <MolWeight> (87)
423.89538

>  <Cat> (87)
S7189

>  <Name> (87)
Molibresib (I-BET-762)

>  <Synonyms> (87)
GSK525762, GSK525762A

>  <Target> (87)
Epigenetic Reader Domain

>  <Form> (87)
free base

>  <CAS> (87)
1260907-17-2

>  <URL> (87)
http://selleckchem.com/products/i-bet-762.html

$$$$
RGFP966.cdx
csChFnd80/07292609462D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (88)
88

>  <Formula> (88)
C21H19FN4O

>  <MolWeight> (88)
362.4001632

>  <Cat> (88)
S7229

>  <Name> (88)
RGFP966

>  <Synonyms> (88)
N/A

>  <Target> (88)
HDAC

>  <Form> (88)
free base

>  <CAS> (88)
1396841-57-8

>  <URL> (88)
http://selleckchem.com/products/rgfp966.html

$$$$
SGC 0946.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (89)
89

>  <Formula> (89)
C28H40BrN7O4

>  <MolWeight> (89)
618.5657

>  <Cat> (89)
S7079

>  <Name> (89)
SGC 0946

>  <Synonyms> (89)
N/A

>  <Target> (89)
DOT1,Histone Methyltransferase

>  <Form> (89)
free base

>  <CAS> (89)
1561178-17-3

>  <URL> (89)
http://selleckchem.com/products/sgc-0946.html

$$$$
EPZ-6438 (E7438).cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (90)
90

>  <Formula> (90)
C34H44N4O4

>  <MolWeight> (90)
572.73756

>  <Cat> (90)
S7128

>  <Name> (90)
Tazemetostat (EPZ-6438)

>  <Synonyms> (90)
E7438

>  <Target> (90)
EZH1/2,Histone Methyltransferase

>  <Form> (90)
free base

>  <CAS> (90)
1403254-99-8

>  <URL> (90)
http://selleckchem.com/products/epz-6438.html

$$$$
RVX-208(RVX-000222).cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (91)
91

>  <Formula> (91)
C20H22N2O5

>  <MolWeight> (91)
370.39908

>  <Cat> (91)
S7295

>  <Name> (91)
Apabetalone (RVX-208)

>  <Synonyms> (91)
RVX-000222

>  <Target> (91)
Epigenetic Reader Domain

>  <Form> (91)
free base

>  <CAS> (91)
1044870-39-4

>  <URL> (91)
http://selleckchem.com/products/rvx-208.html

$$$$
UNC1999.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (92)
92

>  <Formula> (92)
C33H43N7O2

>  <MolWeight> (92)
569.74022

>  <Cat> (92)
S7165

>  <Name> (92)
UNC1999

>  <Synonyms> (92)
N/A

>  <Target> (92)
Apoptosis related,Autophagy,EZH1/2,Histone Methyltransferase

>  <Form> (92)
free base

>  <CAS> (92)
1431612-23-5

>  <URL> (92)
http://selleckchem.com/products/unc1999.html

$$$$
JIB04 (NSC693627).cdx
csChFnd80/07292609462D

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>  <Mol_ID> (93)
93

>  <Formula> (93)
C17H13ClN4

>  <MolWeight> (93)
308.76492

>  <Cat> (93)
S7281

>  <Name> (93)
JIB-04

>  <Synonyms> (93)
NSC 693627

>  <Target> (93)
Apoptosis related,Histone Demethylase,JMJD

>  <Form> (93)
free base

>  <CAS> (93)
199596-05-9

>  <URL> (93)
http://selleckchem.com/products/jib-04.html

$$$$
MM-102.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (94)
94

>  <Formula> (94)
C35H49F2N7O4

>  <MolWeight> (94)
669.8048664

>  <Cat> (94)
S7265

>  <Name> (94)
MM-102

>  <Synonyms> (94)
HMTase Inhibitor IX

>  <Target> (94)
Histone Methyltransferase,MLL

>  <Form> (94)
free base

>  <CAS> (94)
1417329-24-8

>  <URL> (94)
http://selleckchem.com/products/mm-102.html

$$$$
RG2833 (RGFP109).cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (95)
95

>  <Formula> (95)
C20H25N3O2

>  <MolWeight> (95)
339.4314

>  <Cat> (95)
S7292

>  <Name> (95)
RG2833 (RGFP109)

>  <Synonyms> (95)
N/A

>  <Target> (95)
HDAC

>  <Form> (95)
free base

>  <CAS> (95)
1215493-56-3

>  <URL> (95)
http://selleckchem.com/products/rg2833-rgfp109.html

$$$$
SGC-CBP30.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (96)
96

>  <Formula> (96)
C28H33ClN4O3

>  <MolWeight> (96)
509.03962

>  <Cat> (96)
S7256

>  <Name> (96)
SGC-CBP30

>  <Synonyms> (96)
N/A

>  <Target> (96)
Epigenetic Reader Domain,Histone Acetyltransferase

>  <Form> (96)
free base

>  <CAS> (96)
1613695-14-9

>  <URL> (96)
http://selleckchem.com/products/sgc-cbp30.html

$$$$
MK8745.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (97)
97

>  <Formula> (97)
C20H19ClFN5OS

>  <MolWeight> (97)
431.9141632

>  <Cat> (97)
S7065

>  <Name> (97)
MK-8745

>  <Synonyms> (97)
N/A

>  <Target> (97)
Aurora Kinase

>  <Form> (97)
free base

>  <CAS> (97)
885325-71-3

>  <URL> (97)
http://selleckchem.com/products/mk-8745.html

$$$$
UNC669.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (98)
98

>  <Formula> (98)
C15H20BrN3O

>  <MolWeight> (98)
338.2428

>  <Cat> (98)
S7373

>  <Name> (98)
UNC669

>  <Synonyms> (98)
N/A

>  <Target> (98)
Epigenetic Reader Domain

>  <Form> (98)
free base

>  <CAS> (98)
1314241-44-5

>  <URL> (98)
http://selleckchem.com/products/unc669.html

$$$$
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M  END
>  <Mol_ID> (99)
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>  <Formula> (99)
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>  <MolWeight> (99)
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>  <Cat> (99)
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>  <Name> (99)
Birabresib (OTX015)

>  <Synonyms> (99)
MK 8628

>  <Target> (99)
Epigenetic Reader Domain,NSD

>  <Form> (99)
free base

>  <CAS> (99)
202590-98-5

>  <URL> (99)
http://selleckchem.com/products/otx015.html

$$$$
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M  END
>  <Mol_ID> (100)
100

>  <Formula> (100)
C19H23N3O3

>  <MolWeight> (100)
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>  <Cat> (100)
S7473

>  <Name> (100)
Nexturastat A

>  <Synonyms> (100)
N/A

>  <Target> (100)
HDAC

>  <Form> (100)
free base

>  <CAS> (100)
1403783-31-2

>  <URL> (100)
http://selleckchem.com/products/nexturastat-a.html

$$$$
OG-L002.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (101)
101

>  <Formula> (101)
C15H15NO

>  <MolWeight> (101)
225.2857

>  <Cat> (101)
S7237

>  <Name> (101)
OG-L002

>  <Synonyms> (101)
N/A

>  <Target> (101)
Histone Demethylase,LSD1

>  <Form> (101)
free base

>  <CAS> (101)
1357302-64-7

>  <URL> (101)
http://selleckchem.com/products/og-l002.html

$$$$
C646.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (102)
102

>  <Formula> (102)
C24H19N3O6

>  <MolWeight> (102)
445.42416

>  <Cat> (102)
S7152

>  <Name> (102)
C646

>  <Synonyms> (102)
N/A

>  <Target> (102)
Apoptosis related,Autophagy,Epigenetic Reader Domain,Histone Acetyltransferase

>  <Form> (102)
free base

>  <CAS> (102)
328968-36-1

>  <URL> (102)
http://selleckchem.com/products/c646.html

$$$$
UNC1215.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (103)
103

>  <Formula> (103)
C32H43N5O2

>  <MolWeight> (103)
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>  <Cat> (103)
S7088

>  <Name> (103)
UNC1215

>  <Synonyms> (103)
N/A

>  <Target> (103)
Epigenetic Reader Domain

>  <Form> (103)
free base

>  <CAS> (103)
1415800-43-9

>  <URL> (103)
http://selleckchem.com/products/nuc1215.html

$$$$
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    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  3  4  2  0  0  0  0
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M  END
>  <Mol_ID> (104)
104

>  <Formula> (104)
C10H7NO3

>  <MolWeight> (104)
189.16748

>  <Cat> (104)
S7234

>  <Name> (104)
IOX1

>  <Synonyms> (104)
N/A

>  <Target> (104)
Histone Demethylase,JMJD

>  <Form> (104)
free base

>  <CAS> (104)
5852-78-8

>  <URL> (104)
http://selleckchem.com/products/iox1.html

$$$$
XMD8-92.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (105)
105

>  <Formula> (105)
C26H30N6O3

>  <MolWeight> (105)
474.5548

>  <Cat> (105)
S7525

>  <Name> (105)
XMD8-92

>  <Synonyms> (105)
N/A

>  <Target> (105)
Epigenetic Reader Domain,ERK

>  <Form> (105)
free base

>  <CAS> (105)
1234480-50-2

>  <URL> (105)
http://selleckchem.com/products/xmd8-92.html

$$$$
CPI203 .cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (106)
106

>  <Formula> (106)
C19H18ClN5OS

>  <MolWeight> (106)
399.89712

>  <Cat> (106)
S7304

>  <Name> (106)
CPI-203

>  <Synonyms> (106)
N/A

>  <Target> (106)
Epigenetic Reader Domain

>  <Form> (106)
free base

>  <CAS> (106)
1446144-04-2

>  <URL> (106)
http://selleckchem.com/products/cpi-203.html

$$$$
TMP269.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (107)
107

>  <Formula> (107)
C25H21F3N4O3S

>  <MolWeight> (107)
514.5194496

>  <Cat> (107)
S7324

>  <Name> (107)
TMP269

>  <Synonyms> (107)
N/A

>  <Target> (107)
HDAC

>  <Form> (107)
free base

>  <CAS> (107)
1314890-29-3

>  <URL> (107)
http://selleckchem.com/products/tmp269.html

$$$$
MG149.cdx
csChFnd80/07292609462D

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  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
 10 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 11 18  1  0  0  0  0
  4 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (108)
108

>  <Formula> (108)
C22H28O3

>  <MolWeight> (108)
340.45592

>  <Cat> (108)
S7476

>  <Name> (108)
MG149

>  <Synonyms> (108)
Tip60 HAT inhibitor

>  <Target> (108)
Histone Acetyltransferase

>  <Form> (108)
free base

>  <CAS> (108)
1243583-85-8

>  <URL> (108)
http://selleckchem.com/products/mg149.html

$$$$
CAY10683 (Santacruzamate A).cdx
csChFnd80/07292609462D

 20 20  0  0  0  0  0  0  0  0999 V2000
   14.5492    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 10 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (109)
109

>  <Formula> (109)
C15H22N2O3

>  <MolWeight> (109)
278.34678

>  <Cat> (109)
S7595

>  <Name> (109)
Santacruzamate A (CAY10683)

>  <Synonyms> (109)
N/A

>  <Target> (109)
HDAC

>  <Form> (109)
free base

>  <CAS> (109)
1477949-42-0

>  <URL> (109)
http://selleckchem.com/products/santacruzamate-a-cay10683.html

$$$$
PFI-3.cdx
csChFnd80/07292609462D

 24 27  0  0  0  0  0  0  0  0999 V2000
    0.0000    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.8000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.2000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.4871    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2646    3.7900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 10  1  0  0  0  0
 11 16  1  1  0  0  0
 14 16  1  1  0  0  0
  7 17  2  0  0  0  0
  4 18  1  0  0  0  0
 13 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 19  1  0  0  0  0
M  END
>  <Mol_ID> (110)
110

>  <Formula> (110)
C19H19N3O2

>  <MolWeight> (110)
321.37306

>  <Cat> (110)
S7315

>  <Name> (110)
PFI-3

>  <Synonyms> (110)
N/A

>  <Target> (110)
Epigenetic Reader Domain

>  <Form> (110)
free base

>  <CAS> (110)
1819363-80-8

>  <URL> (110)
http://selleckchem.com/products/pfi-3.html

$$$$
Tasquinimod .cdx
csChFnd80/07292609462D

 29 31  0  0  0  0  0  0  0  0999 V2000
    0.0000    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    5.6000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    7.7000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    7.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  8 11  2  0  0  0  0
 10 12  1  0  0  0  0
  6 13  1  0  0  0  0
 13 14  1  0  0  0  0
  7 15  1  0  0  0  0
  9 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 17 20  1  0  0  0  0
 19 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 19  1  0  0  0  0
 23 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  0  0  0  0
M  END
>  <Mol_ID> (111)
111

>  <Formula> (111)
C20H17F3N2O4

>  <MolWeight> (111)
406.3551896

>  <Cat> (111)
S7617

>  <Name> (111)
Tasquinimod

>  <Synonyms> (111)
ABR-215050

>  <Target> (111)
HDAC

>  <Form> (111)
free base

>  <CAS> (111)
254964-60-8

>  <URL> (111)
http://selleckchem.com/products/tasquinimod.html

$$$$
Anacardic Acid.cdx
csChFnd80/07292609462D

 25 25  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  4 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (112)
112

>  <Formula> (112)
C22H36O3

>  <MolWeight> (112)
348.51944

>  <Cat> (112)
S7582

>  <Name> (112)
Anacardic Acid

>  <Synonyms> (112)
6-pentadecylsalicylic Acid

>  <Target> (112)
Epigenetic Reader Domain,Histone Acetyltransferase

>  <Form> (112)
free base

>  <CAS> (112)
16611-84-0

>  <URL> (112)
http://selleckchem.com/products/anacardic-acid.html

$$$$
Splitomicin.cdx
csChFnd80/07292609462D

 15 17  0  0  0  0  0  0  0  0999 V2000
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  1  1  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (113)
113

>  <Formula> (113)
C13H10O2

>  <MolWeight> (113)
198.2173

>  <Cat> (113)
S7593

>  <Name> (113)
Splitomicin

>  <Synonyms> (113)
N/A

>  <Target> (113)
HDAC

>  <Form> (113)
free base

>  <CAS> (113)
5690-03-9

>  <URL> (113)
http://selleckchem.com/products/splitomicin.html

$$$$
PFI-2.cdx
csChFnd80/07292609462D

 34 37  0  0  0  0  0  0  0  0999 V2000
    2.4249    3.5544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.4544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.5544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1544    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.4544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0544    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.2544    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.5544    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    3.5544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    4.2544    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    6.3544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    5.6544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    6.3544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    8.4544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    7.7544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    9.8544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   10.5544    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   10.5544    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   11.2544    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    8.5669    1.3315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9995    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3995    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8321    1.3315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
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  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  2  1  0  0  0  0
  3 11  1  0  0  0  0
  5 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 12 18  2  0  0  0  0
 12 19  2  0  0  0  0
 14 20  1  6  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 21  1  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27 30  1  0  0  0  0
 17 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 17  1  0  0  0  0
M  END
>  <Mol_ID> (114)
114

>  <Formula> (114)
C23H25F4N3O3S

>  <MolWeight> (114)
499.5215128

>  <Cat> (114)
S7294

>  <Name> (114)
PFI-2 HCl

>  <Synonyms> (114)
N/A

>  <Target> (114)
Histone Methyltransferase,SETD

>  <Form> (114)
Hydrochloride

>  <CAS> (114)
1627607-87-7

>  <URL> (114)
http://selleckchem.com/products/pfi-2.html

$$$$
MI-3.cdx
csChFnd80/07292609462D

 25 28  0  0  0  0  0  0  0  0999 V2000
    0.8876   11.2067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1000    9.1067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3124   11.2067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000   11.9067    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6439    9.3741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4668   10.5067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6439   11.6393    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3124    5.6067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1000    3.5067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4000    1.3523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8000    1.3523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.5668   11.7191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    1.3523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7623    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  3 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 10  1  0  0  0  0
 13 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 16  2  0  0  0  0
  8 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
 18 24  1  0  0  0  0
 18 25  1  0  0  0  0
M  END
>  <Mol_ID> (115)
115

>  <Formula> (115)
C18H25N5S2

>  <MolWeight> (115)
375.5546

>  <Cat> (115)
S7619

>  <Name> (115)
MI-3 (Menin-MLL Inhibitor)

>  <Synonyms> (115)
N/A

>  <Target> (115)
Histone Methyltransferase,MLL

>  <Form> (115)
free base

>  <CAS> (115)
1271738-59-0

>  <URL> (115)
http://selleckchem.com/products/mi-3-menin-mll-inhibitor.html

$$$$
MI-2 (Menin-MLL inhibitor).cdx
csChFnd80/07292609462D

 25 28  0  0  0  0  0  0  0  0999 V2000
    0.7665    7.0467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7665    5.6467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9790    4.9467    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1914    5.6467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1914    7.0467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1914   11.2467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9790   11.9467    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    4.5229   11.6793    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    7.4458   11.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8458   11.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9790    3.5467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6790    1.3923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1116    2.7238    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1326    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12  7  1  0  0  0  0
  8 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15  9  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
  3 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 19  2  0  0  0  0
 21 24  1  0  0  0  0
 25 21  1  0  0  0  0
M  END
>  <Mol_ID> (116)
116

>  <Formula> (116)
C18H25N5S2

>  <MolWeight> (116)
375.5546

>  <Cat> (116)
S7618

>  <Name> (116)
MI-2 (Menin-MLL Inhibitor)

>  <Synonyms> (116)
N/A

>  <Target> (116)
Histone Methyltransferase,MLL

>  <Form> (116)
free base

>  <CAS> (116)
1271738-62-5

>  <URL> (116)
http://selleckchem.com/products/mi-2-menin-mll-inhibitor.html

$$$$
SP2509.cdx
csChFnd80/07292609462D

 29 31  0  0  0  0  0  0  0  0999 V2000
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.8000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    3.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5492    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6368    4.0124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0368    1.5876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  5  7  1  0  0  0  0
  2  8  1  0  0  0  0
  4  9  1  0  0  0  0
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 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
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 17 18  1  0  0  0  0
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 19 14  1  0  0  0  0
 18 20  1  0  0  0  0
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 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 21  1  0  0  0  0
 20 27  2  0  0  0  0
 20 28  2  0  0  0  0
 13 29  2  0  0  0  0
M  END
>  <Mol_ID> (117)
117

>  <Formula> (117)
C19H20ClN3O5S

>  <MolWeight> (117)
437.8972

>  <Cat> (117)
S7680

>  <Name> (117)
SP2509

>  <Synonyms> (117)
HCI-2509

>  <Target> (117)
Apoptosis related,Autophagy,Histone Demethylase,LSD1

>  <Form> (117)
free base

>  <CAS> (117)
1423715-09-6

>  <URL> (117)
http://selleckchem.com/products/sp2509.html

$$$$
GSK1324726A (I-BET726).cdx
csChFnd80/07292609462D

 31 34  0  0  0  0  0  0  0  0999 V2000
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4870    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (118)
118

>  <Formula> (118)
C25H23ClN2O3

>  <MolWeight> (118)
434.91472

>  <Cat> (118)
S7620

>  <Name> (118)
GSK1324726A (I-BET726)

>  <Synonyms> (118)
N/A

>  <Target> (118)
Epigenetic Reader Domain

>  <Form> (118)
free base

>  <CAS> (118)
1300031-52-0

>  <URL> (118)
http://selleckchem.com/products/gsk1324726a-i-bet726.html

$$$$
BRD4770.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (119)
119

>  <Formula> (119)
C25H23N3O3

>  <MolWeight> (119)
413.46842

>  <Cat> (119)
S7591

>  <Name> (119)
BRD4770

>  <Synonyms> (119)
N/A

>  <Target> (119)
G9a/GLP,Histone Methyltransferase

>  <Form> (119)
free base

>  <CAS> (119)
1374601-40-7

>  <URL> (119)
http://selleckchem.com/products/brd4770.html

$$$$
Reversine.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (120)
120

>  <Formula> (120)
C21H27N7O

>  <MolWeight> (120)
393.48538

>  <Cat> (120)
S7588

>  <Name> (120)
Reversine

>  <Synonyms> (120)
N/A

>  <Target> (120)
Adenosine Receptor,Aurora Kinase

>  <Form> (120)
free base

>  <CAS> (120)
656820-32-5

>  <URL> (120)
http://selleckchem.com/products/reversine.html

$$$$
CAY10603.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (121)
121

>  <Formula> (121)
C22H30N4O6

>  <MolWeight> (121)
446.4968

>  <Cat> (121)
S7596

>  <Name> (121)
CAY10603

>  <Synonyms> (121)
BML-281

>  <Target> (121)
HDAC

>  <Form> (121)
free base

>  <CAS> (121)
1045792-66-2

>  <URL> (121)
http://selleckchem.com/products/cay10603.html

$$$$
LMK-235.cdx
csChFnd80/07292609462D

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>  <Target> (122)
HDAC

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free base

>  <CAS> (122)
1418033-25-6

>  <URL> (122)
http://selleckchem.com/products/lmk-235.html

$$$$
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>  <Formula> (123)
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MS436

>  <Synonyms> (123)
N/A

>  <Target> (123)
Epigenetic Reader Domain

>  <Form> (123)
free base

>  <CAS> (123)
1395084-25-9

>  <URL> (123)
http://selleckchem.com/products/ms436.html

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>  <Mol_ID> (124)
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>  <Formula> (124)
C17H18N2O4

>  <MolWeight> (124)
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>  <Cat> (124)
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>  <Name> (124)
HPOB

>  <Synonyms> (124)
N/A

>  <Target> (124)
HDAC

>  <Form> (124)
free base

>  <CAS> (124)
1429651-50-2

>  <URL> (124)
http://selleckchem.com/products/hpob.html

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>  <Formula> (125)
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ML324

>  <Synonyms> (125)
N/A

>  <Target> (125)
CMV,Histone Demethylase,JMJD

>  <Form> (125)
free base

>  <CAS> (125)
1222800-79-4

>  <URL> (125)
http://selleckchem.com/products/ml324.html

$$$$
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>  <Formula> (126)
C23H21N5O3S

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>  <Synonyms> (126)
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>  <Target> (126)
HDAC

>  <Form> (126)
free base

>  <CAS> (126)
910462-43-0

>  <URL> (126)
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 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (127)
127

>  <Formula> (127)
C17H18BrN3O4S

>  <MolWeight> (127)
440.31152

>  <Cat> (127)
S7681

>  <Name> (127)
OF-1

>  <Synonyms> (127)
N/A

>  <Target> (127)
Epigenetic Reader Domain

>  <Form> (127)
free base

>  <CAS> (127)
919973-83-4

>  <URL> (127)
http://selleckchem.com/products/of-1.html

$$$$
UNC0379.cdx
csChFnd80/07292609462D

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    3.6373    1.6834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7028    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.4831    4.4911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8525    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5525    5.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6158    6.4528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
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  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
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  2 13  1  0  0  0  0
 13 14  1  0  0  0  0
  8 15  1  0  0  0  0
 10 16  1  0  0  0  0
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 15 23  1  0  0  0  0
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M  END
>  <Mol_ID> (128)
128

>  <Formula> (128)
C23H35N5O2

>  <MolWeight> (128)
413.5563

>  <Cat> (128)
S7570

>  <Name> (128)
UNC0379

>  <Synonyms> (128)
N/A

>  <Target> (128)
Histone Methyltransferase,SETD

>  <Form> (128)
free base

>  <CAS> (128)
1620401-82-2

>  <URL> (128)
http://selleckchem.com/products/unc0379.html

$$$$
GSK-LSD1  dihydrochloride.cdx
csChFnd80/07292609462D

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  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
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 10  8  1  0  0  0  0
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M  END
>  <Mol_ID> (129)
129

>  <Formula> (129)
C14H22Cl2N2

>  <MolWeight> (129)
289.24388

>  <Cat> (129)
S7574

>  <Name> (129)
GSK-LSD1 2HCl

>  <Synonyms> (129)
N/A

>  <Target> (129)
Histone Demethylase,LSD1

>  <Form> (129)
dihydrochloride

>  <CAS> (129)
2102933-95-7

>  <URL> (129)
http://selleckchem.com/products/gsk-lsd1-2hcl.html

$$$$
GSK126.cdx
csChFnd80/07292609462D

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    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.8539    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 12  7  1  0  0  0  0
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 39 34  1  0  0  0  0
M  END
>  <Mol_ID> (130)
130

>  <Formula> (130)
C31H38N6O2

>  <MolWeight> (130)
526.67242

>  <Cat> (130)
S7061

>  <Name> (130)
GSK126

>  <Synonyms> (130)
GSK2816126A, GSK2816126

>  <Target> (130)
EZH1/2,Histone Methyltransferase

>  <Form> (130)
Free Base

>  <CAS> (130)
1346574-57-9

>  <URL> (130)
http://selleckchem.com/products/gsk126.html

$$$$
EPZ015666.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (131)
131

>  <Formula> (131)
C20H25N5O3

>  <MolWeight> (131)
383.4442

>  <Cat> (131)
S7748

>  <Name> (131)
EPZ015666 (GSK3235025)

>  <Synonyms> (131)
GSK3235025

>  <Target> (131)
Histone Methyltransferase,PRMT

>  <Form> (131)
free base

>  <CAS> (131)
1616391-65-1

>  <URL> (131)
http://selleckchem.com/products/epz015666.html

$$$$
SRT2104 (GSK2245840).cdx
csChFnd80/07292609462D

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>  <Mol_ID> (132)
132

>  <Formula> (132)
C26H24N6O2S2

>  <MolWeight> (132)
516.63776

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S7792

>  <Name> (132)
SRT2104 (GSK2245840)

>  <Synonyms> (132)
N/A

>  <Target> (132)
Sirtuin

>  <Form> (132)
free base

>  <CAS> (132)
1093403-33-8

>  <URL> (132)
http://selleckchem.com/products/srt2104-gsk2245840.html

$$$$
BRD73954.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (133)
133

>  <Formula> (133)
C16H16N2O3

>  <MolWeight> (133)
284.30984

>  <Cat> (133)
S7726

>  <Name> (133)
BRD73954

>  <Synonyms> (133)
N/A

>  <Target> (133)
HDAC

>  <Form> (133)
free base

>  <CAS> (133)
1440209-96-0

>  <URL> (133)
http://selleckchem.com/products/brd73954.html

$$$$
GSK J1.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (134)
134

>  <Formula> (134)
C22H23N5O2

>  <MolWeight> (134)
389.45032

>  <Cat> (134)
S7581

>  <Name> (134)
GSK J1

>  <Synonyms> (134)
N/A

>  <Target> (134)
Histone Demethylase,JMJD

>  <Form> (134)
free base

>  <CAS> (134)
1373422-53-7

>  <URL> (134)
http://selleckchem.com/products/gsk-j1.html

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135

>  <Formula> (135)
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BG45

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N/A

>  <Target> (135)
HDAC

>  <Form> (135)
free base

>  <CAS> (135)
926259-99-6

>  <URL> (135)
http://selleckchem.com/products/bg45.html

$$$$
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M  END
>  <Mol_ID> (136)
136

>  <Formula> (136)
C21H24N4O3

>  <MolWeight> (136)
380.44026

>  <Cat> (136)
S7906

>  <Name> (136)
PFI-4

>  <Synonyms> (136)
N/A

>  <Target> (136)
Epigenetic Reader Domain

>  <Form> (136)
free base

>  <CAS> (136)
900305-37-5

>  <URL> (136)
http://selleckchem.com/products/pfi-4.html

$$$$
ORY-1001.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (137)
137

>  <Formula> (137)
C15H24Cl2N2

>  <MolWeight> (137)
303.27046

>  <Cat> (137)
S7795

>  <Name> (137)
Iadademstat (ORY-1001) 2HCl

>  <Synonyms> (137)
RG-6016

>  <Target> (137)
Histone Demethylase,LSD1

>  <Form> (137)
dihydrochloride

>  <CAS> (137)
1431326-61-2

>  <URL> (137)
http://selleckchem.com/products/ory-1001-rg-6016.html

$$$$
SGC707.cdx
csChFnd80/07292609462D

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 22 17  1  0  0  0  0
M  END
>  <Mol_ID> (138)
138

>  <Formula> (138)
C16H18N4O2

>  <MolWeight> (138)
298.33972

>  <Cat> (138)
S7832

>  <Name> (138)
SGC707

>  <Synonyms> (138)
N/A

>  <Target> (138)
Histone Methyltransferase,PRMT

>  <Form> (138)
free base

>  <CAS> (138)
1687736-54-4

>  <URL> (138)
http://selleckchem.com/products/sgc707.html

$$$$
GSK2879552.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (139)
139

>  <Formula> (139)
C23H30Cl2N2O2

>  <MolWeight> (139)
437.4025

>  <Cat> (139)
S7796

>  <Name> (139)
GSK2879552 2HCl

>  <Synonyms> (139)
N/A

>  <Target> (139)
Histone Demethylase,LSD1

>  <Form> (139)
dihydrochloride

>  <CAS> (139)
1902123-72-1

>  <URL> (139)
http://selleckchem.com/products/gsk2879552-2hcl.html

$$$$
MS023.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (140)
140

>  <Formula> (140)
C17H25N3O

>  <MolWeight> (140)
287.3999

>  <Cat> (140)
S8112

>  <Name> (140)
MS023

>  <Synonyms> (140)
N/A

>  <Target> (140)
Histone Methyltransferase,PRMT

>  <Form> (140)
free base

>  <CAS> (140)
1831110-54-3

>  <URL> (140)
http://selleckchem.com/products/ms023.html

$$$$
Chaetocin.cdx
csChFnd80/07292609462D

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   14.1344    3.4204    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.7685    2.2844    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.5838    7.0622    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.8227    9.2616    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5672    5.6579    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7450    3.4265    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   15.4917    4.1695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2195    4.9048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2630    0.4128    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4567    8.7112    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.2647    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9172    6.7297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.8803    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  1  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  2  8  1  1  0  0  0
  3  9  1  0  0  0  0
  3 10  1  0  0  0  0
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 10 11  1  0  0  0  0
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 17 24  1  0  0  0  0
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 20 27  1  0  0  0  0
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 22 29  1  0  0  0  0
 23 30  1  0  0  0  0
 23 31  2  0  0  0  0
 24 32  1  0  0  0  0
 24 33  2  0  0  0  0
 25 34  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  1  0  0  0
 28 35  1  0  0  0  0
 30 36  1  0  0  0  0
 30 32  1  0  0  0  0
 30 34  1  1  0  0  0
 32 37  1  0  0  0  0
 36 40  1  0  0  0  0
  7 41  1  0  0  0  0
 41 42  2  0  0  0  0
 42 43  1  0  0  0  0
 43 44  2  0  0  0  0
 44 16  1  0  0  0  0
 26 45  1  0  0  0  0
 45 46  1  0  0  0  0
 21 47  2  0  0  0  0
 18 48  2  0  0  0  0
M  END
>  <Mol_ID> (141)
141

>  <Formula> (141)
C30H28N6O6S4

>  <MolWeight> (141)
696.83992

>  <Cat> (141)
S8068

>  <Name> (141)
Chaetocin

>  <Synonyms> (141)
N/A

>  <Target> (141)
Anti-infection,G9a/GLP,Histone Methyltransferase,Thioredoxin Reductase

>  <Form> (141)
free base

>  <CAS> (141)
28097-03-2

>  <URL> (141)
http://selleckchem.com/products/chaetocin.html

$$$$
PF-CBP1.cdx
csChFnd80/07292609462D

 37 40  0  0  0  0  0  0  0  0999 V2000
    3.4282    4.9037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4282    3.5037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6406    2.8037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8531    3.5037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8531    4.9037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6406    5.6037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1845    3.0710    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0074    4.2037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1845    5.3363    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6172    6.6678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9866    6.9588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4192    8.2903    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.7886    8.5814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2212    9.9129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2844   10.9533    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9150   10.6622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7074    2.9912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 16 17  1  0  0  0  0
 17 12  1  0  0  0  0
  2 18  1  0  0  0  0
  8 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 18 22  1  0  0  0  0
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 25 18  2  0  0  0  0
 21 26  2  0  0  0  0
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 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 21  1  0  0  0  0
 25 31  1  0  0  0  0
 22 32  1  0  0  0  0
 28 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
M  END
>  <Mol_ID> (142)
142

>  <Formula> (142)
C29H37ClN4O3

>  <MolWeight> (142)
525.08208

>  <Cat> (142)
S8180

>  <Name> (142)
PF-CBP1 HCl

>  <Synonyms> (142)
N/A

>  <Target> (142)
Epigenetic Reader Domain

>  <Form> (142)
Hydrochloride

>  <CAS> (142)
2070014-93-4

>  <URL> (142)
http://selleckchem.com/products/pf-cbp1.html

$$$$
GSK591 (EPZ015866, GSK3203591).cdx
csChFnd80/07292609462D

 28 31  0  0  0  0  0  0  0  0999 V2000
    4.1395    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.3520    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9271    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7146    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7768    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9893    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.7768    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2017    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4141    2.1000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   12.6266    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4141    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8390    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.8390    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0514    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.2639    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0514    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  5  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  1  0  0  0
 14 16  1  0  0  0  0
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 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 20  1  0  0  0  0
  8 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28  8  1  0  0  0  0
M  END
>  <Mol_ID> (143)
143

>  <Formula> (143)
C22H28N4O2

>  <MolWeight> (143)
380.48332

>  <Cat> (143)
S8111

>  <Name> (143)
GSK591

>  <Synonyms> (143)
EPZ015866, GSK3203591

>  <Target> (143)
Histone Methyltransferase,PRMT

>  <Form> (143)
free base

>  <CAS> (143)
1616391-87-7

>  <URL> (143)
http://selleckchem.com/products/gsk591-epz015866-gsk3203591.html

$$$$
HLCL-61.cdx
csChFnd80/07292609462D

 27 29  0  0  0  0  0  0  0  0999 V2000
    0.1575    4.9929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.3840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1260    7.2159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4095    6.6567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4410    4.4337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6838    7.2364    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6289    6.2035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8858    2.4825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2822    2.4736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9762    1.2577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2703    0.0487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8883    4.9118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9640    8.6081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.4067    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
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  8  9  2  0  0  0  0
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  8 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13  9  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
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 18 23  1  0  0  0  0
 23 24  1  0  0  0  0
  7 25  1  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (144)
144

>  <Formula> (144)
C23H25ClN2O

>  <MolWeight> (144)
380.9104

>  <Cat> (144)
S8209

>  <Name> (144)
HLCL-61 HCL

>  <Synonyms> (144)
HLCL61

>  <Target> (144)
Histone Methyltransferase,PRMT

>  <Form> (144)
hydrochloride

>  <CAS> (144)
1158279-20-9

>  <URL> (144)
http://selleckchem.com/products/hlcl-61-hydrochloride.html

$$$$
I-BRD9 (GSK602).cdx
csChFnd80/07292609462D

 33 36  0  0  0  0  0  0  0  0999 V2000
    2.4249    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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1883429-21-7

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http://selleckchem.com/products/bi-7273.html

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G9a/GLP,Histone Methyltransferase

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free base

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1527503-11-2

>  <URL> (147)
http://selleckchem.com/products/a-366.html

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N/A

>  <Target> (149)
Epigenetic Reader Domain

>  <Form> (149)
Free Base

>  <CAS> (149)
1883429-22-8

>  <URL> (149)
http://selleckchem.com/products/bi-9564.html

$$$$
NSC228155.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (150)
150

>  <Formula> (150)
C11H6N4O4S

>  <MolWeight> (150)
290.25474

>  <Cat> (150)
S8312

>  <Name> (150)
NSC228155

>  <Synonyms> (150)
N/A

>  <Target> (150)
EGFR

>  <Form> (150)
free base

>  <CAS> (150)
113104-25-9

>  <URL> (150)
http://selleckchem.com/products/nsc228155.html

$$$$
CPI-637.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (151)
151

>  <Formula> (151)
C22H22N6O

>  <MolWeight> (151)
386.44968

>  <Cat> (151)
S8190

>  <Name> (151)
CPI-637

>  <Synonyms> (151)
N/A

>  <Target> (151)
Epigenetic Reader Domain,Histone Acetyltransferase

>  <Form> (151)
free base

>  <CAS> (151)
1884712-47-3

>  <URL> (151)
http://selleckchem.com/products/cpi-637.html

$$$$
OICR-9429.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (152)
152

>  <Formula> (152)
C29H32F3N5O3

>  <MolWeight> (152)
555.5912896

>  <Cat> (152)
S7833

>  <Name> (152)
OICR-9429

>  <Synonyms> (152)
N/A

>  <Target> (152)
Histone Methyltransferase,WDR5

>  <Form> (152)
free base

>  <CAS> (152)
1801787-56-3

>  <URL> (152)
http://selleckchem.com/products/oicr-9429.html

$$$$
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>  <Mol_ID> (153)
153

>  <Formula> (153)
C27H33F3N4O3

>  <MolWeight> (153)
518.5711296

>  <Cat> (153)
S8353

>  <Name> (153)
Lirametostat (CPI-1205)

>  <Synonyms> (153)
CPI 1205, CPI1205

>  <Target> (153)
EZH1/2,Histone Methyltransferase

>  <Form> (153)
free base

>  <CAS> (153)
1621862-70-1

>  <URL> (153)
http://selleckchem.com/products/cpi-1205.html

$$$$

csChFnd80/07292609462D

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>  <Mol_ID> (154)
154

>  <Formula> (154)
C20H25N3O2

>  <MolWeight> (154)
339.4314

>  <Cat> (154)
S1073

>  <Name> (154)
BML-210 (CAY10433)

>  <Synonyms> (154)
N/A

>  <Target> (154)
HDAC

>  <Form> (154)
Free Base

>  <CAS> (154)
537034-17-6

>  <URL> (154)
http://www.selleck.cn/products/bml210-cay10433.html

$$$$
UNC3866.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (155)
155

>  <Formula> (155)
C43H66N6O8

>  <MolWeight> (155)
795.01954

>  <Cat> (155)
S8359

>  <Name> (155)
UNC3866

>  <Synonyms> (155)
N/A

>  <Target> (155)
Histone Methyltransferase

>  <Form> (155)
free base

>  <CAS> (155)
1872382-47-2

>  <URL> (155)
http://selleckchem.com/products/unc3866.html

$$$$
MS049.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (156)
156

>  <Formula> (156)
C15H26Cl2N2O

>  <MolWeight> (156)
321.28574

>  <Cat> (156)
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>  <Name> (156)
MS049

>  <Synonyms> (156)
N/A

>  <Target> (156)
Histone Methyltransferase,PRMT

>  <Form> (156)
dihydrochloride

>  <CAS> (156)
2095432-59-8

>  <URL> (156)
http://selleckchem.com/products/ms049.html

$$$$
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M  END
>  <Mol_ID> (157)
157

>  <Formula> (157)
C27H24N4O2S

>  <MolWeight> (157)
468.57006

>  <Cat> (157)
S8270

>  <Name> (157)
SRT2183

>  <Synonyms> (157)
N/A

>  <Target> (157)
Sirtuin

>  <Form> (157)
free base

>  <CAS> (157)
1001908-89-9

>  <URL> (157)
http://selleckchem.com/products/srt2183.html

$$$$
UNC0638.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (158)
158

>  <Formula> (158)
C30H47N5O2

>  <MolWeight> (158)
509.72648

>  <Cat> (158)
S8071

>  <Name> (158)
UNC0638

>  <Target> (158)
Antiviral,G9a/GLP,Histone Methyltransferase

>  <Form> (158)
free base

>  <CAS> (158)
1255580-76-7

>  <URL> (158)
http://selleckchem.com/products/unc0638.html

$$$$
EPZ020411.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (159)
159

>  <Formula> (159)
C25H40Cl2N4O3

>  <MolWeight> (159)
515.5161

>  <Cat> (159)
S7820

>  <Name> (159)
EPZ020411 2HCl

>  <Synonyms> (159)
N/A

>  <Target> (159)
Histone Methyltransferase,PRMT

>  <Form> (159)
dihydrochloride

>  <CAS> (159)
2070015-25-5

>  <URL> (159)
http://selleckchem.com/products/epz020411.html

$$$$
Thiomyristoyl.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (160)
160

>  <Formula> (160)
C34H51N3O3S

>  <MolWeight> (160)
581.85204

>  <Cat> (160)
S8245

>  <Name> (160)
Thiomyristoyl

>  <Synonyms> (160)
TM

>  <Target> (160)
Sirtuin

>  <Form> (160)
free base

>  <CAS> (160)
1429749-41-6

>  <URL> (160)
http://selleckchem.com/products/thiomyristoyl.html

$$$$
Salermide.cdx
csChFnd80/07292609462D

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N/A

>  <Target> (161)
Sirtuin

>  <Form> (161)
free base

>  <CAS> (161)
1105698-15-4

>  <URL> (161)
http://selleckchem.com/products/salermide.html

$$$$
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>  <Mol_ID> (162)
162

>  <Formula> (162)
C22H19F2N3O4S

>  <MolWeight> (162)
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>  <Cat> (162)
S8400

>  <Name> (162)
Mivebresib (ABBV-075)

>  <Synonyms> (162)
N/A

>  <Target> (162)
Apoptosis related,Epigenetic Reader Domain

>  <Form> (162)
free base

>  <CAS> (162)
1445993-26-9

>  <URL> (162)
http://selleckchem.com/products/mivebresib-abbv-075.html

$$$$
Citarinostat (ACY-241).cdx
csChFnd80/07292609462D

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>  <Mol_ID> (163)
163

>  <Formula> (163)
C24H26ClN5O3

>  <MolWeight> (163)
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S8464

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Citarinostat (ACY-241)

>  <Synonyms> (163)
HDAC-IN-2

>  <Target> (163)
HDAC

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free base

>  <CAS> (163)
1316215-12-9

>  <URL> (163)
http://selleckchem.com/products/citarinostat-acy-241.html

$$$$
GSK6853.cdx
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>  <Mol_ID> (164)
164

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GSK6853

>  <Synonyms> (164)
N/A

>  <Target> (164)
Epigenetic Reader Domain

>  <Form> (164)
free base

>  <CAS> (164)
1910124-24-1

>  <URL> (164)
http://selleckchem.com/products/gsk6853.html

$$$$
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M  END
>  <Mol_ID> (165)
165

>  <Formula> (165)
C31H32ClN5O2S2

>  <MolWeight> (165)
606.20108

>  <Cat> (165)
S8481

>  <Name> (165)
SRT3025 HCl

>  <Synonyms> (165)
N/A

>  <Target> (165)
Sirtuin

>  <Form> (165)
hydrochloride

>  <CAS> (165)
2070015-26-6

>  <URL> (165)
http://selleckchem.com/products/srt3025.html

$$$$
EED226.cdx
csChFnd80/07292609462D

 26 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (166)
166

>  <Formula> (166)
C17H15N5O3S

>  <MolWeight> (166)
369.3977

>  <Cat> (166)
S8496

>  <Name> (166)
EED226

>  <Synonyms> (166)
N/A

>  <Target> (166)
Epigenetic Reader Domain,Histone Methyltransferase

>  <Form> (166)
free base

>  <CAS> (166)
2083627-02-3

>  <URL> (166)
http://selleckchem.com/products/eed226.html

$$$$
BIX01294 3HCl.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (167)
167

>  <Formula> (167)
C28H41Cl3N6O2

>  <MolWeight> (167)
600.02314

>  <Cat> (167)
S8006

>  <Name> (167)
BIX 01294

>  <Synonyms> (167)
N/A

>  <Target> (167)
Autophagy,G9a/GLP,Histone Methyltransferase,NSD

>  <Form> (167)
trihydrochloride

>  <CAS> (167)
1392399-03-9

>  <URL> (167)
http://selleckchem.com/products/bix-01294.html

$$$$
Cl-amidine.cdx
csChFnd80/07292609462D

 28 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (168)
168

>  <Formula> (168)
C16H20ClF3N4O4

>  <MolWeight> (168)
424.8026096

>  <Cat> (168)
S8141

>  <Name> (168)
Cl-amidine

>  <Synonyms> (168)
N/A

>  <Target> (168)
Apoptosis related,Immunology & Inflammation related,PAD

>  <Form> (168)
trifluoroacetate

>  <CAS> (168)
1043444-18-3

>  <URL> (168)
http://selleckchem.com/products/cl-amidine.html

$$$$
A-196.cdx
csChFnd80/07292609462D

 24 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (169)
169

>  <Formula> (169)
C18H16Cl2N4

>  <MolWeight> (169)
359.25244

>  <Cat> (169)
S7983

>  <Name> (169)
A-196

>  <Synonyms> (169)
N/A

>  <Target> (169)
Histone Methyltransferase,SETD

>  <Form> (169)
free base

>  <CAS> (169)
1982372-88-2

>  <URL> (169)
http://selleckchem.com/products/a-196.html

$$$$
SGC2085.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (170)
170

>  <Formula> (170)
C19H24N2O2

>  <MolWeight> (170)
312.40606

>  <Cat> (170)
S8340

>  <Name> (170)
SGC2085

>  <Synonyms> (170)
N/A

>  <Target> (170)
Histone Methyltransferase,PRMT

>  <Form> (170)
free base

>  <CAS> (170)
1821908-48-8

>  <URL> (170)
http://selleckchem.com/products/sgc2085.html

$$$$
TMP195.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (171)
171

>  <Formula> (171)
C23H19F3N4O3

>  <MolWeight> (171)
456.4171696

>  <Cat> (171)
S8502

>  <Name> (171)
TMP195

>  <Synonyms> (171)
TFMO 2

>  <Target> (171)
HDAC

>  <Form> (171)
free base

>  <CAS> (171)
1314891-22-9

>  <URL> (171)
http://selleckchem.com/products/tmp195.html

$$$$
SF2523.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (172)
172

>  <Formula> (172)
C19H17NO5S

>  <MolWeight> (172)
371.40698

>  <Cat> (172)
S8589

>  <Name> (172)
SF2523

>  <Synonyms> (172)
N/A

>  <Target> (172)
DNA-PK,Epigenetic Reader Domain,mTOR,PI3K

>  <Form> (172)
free base

>  <CAS> (172)
1174428-47-7

>  <URL> (172)
http://selleckchem.com/products/sf2523.html

$$$$
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csChFnd80/07292609462D

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C22H19FN4O2

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Tucidinostat (Chidamide)

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HBI-8000, CS-055

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HDAC

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free base

>  <CAS> (173)
1616493-44-7

>  <URL> (173)
http://selleckchem.com/products/tucidinostat-chidamide.html

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174

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3-TYP

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3-(1H-1,2,3-triazol-4-yl) pyridine

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Sirtuin

>  <Form> (174)
free base

>  <CAS> (174)
120241-79-4

>  <URL> (174)
http://selleckchem.com/products/3-typ.html

$$$$
PF-06726304.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (175)
175

>  <Formula> (175)
C22H21Cl2N3O3

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S8494

>  <Name> (175)
PF-06726304

>  <Synonyms> (175)
PF-6726304

>  <Target> (175)
EZH1/2,Histone Methyltransferase

>  <Form> (175)
free base

>  <CAS> (175)
1616287-82-1

>  <URL> (175)
http://selleckchem.com/products/pf-06726304.html

$$$$
ACY-738.cdx
csChFnd80/07292609462D

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>  <Mol_ID> (176)
176

>  <Formula> (176)
C14H14N4O2

>  <MolWeight> (176)
270.28656

>  <Cat> (176)
S8648

>  <Name> (176)
ACY-738

>  <Synonyms> (176)
N/A

>  <Target> (176)
HDAC

>  <Form> (176)
free base

>  <CAS> (176)
1375465-91-0

>  <URL> (176)
http://selleckchem.com/products/acy-738.html

$$$$
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>  <Mol_ID> (177)
177

>  <Formula> (177)
C24H32N6O3

>  <MolWeight> (177)
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>  <Cat> (177)
S8664

>  <Name> (177)
Pemrametostat (GSK3326595)

>  <Synonyms> (177)
EPZ015938

>  <Target> (177)
Histone Methyltransferase,PRMT

>  <Form> (177)
free base

>  <CAS> (177)
1616392-22-3

>  <URL> (177)
http://selleckchem.com/products/gsk3326595-epz015938.html

$$$$
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M  END
>  <Mol_ID> (178)
178

>  <Formula> (178)
C19H14N2O6

>  <MolWeight> (178)
366.32426

>  <Cat> (178)
S8627

>  <Name> (178)
OSS_128167

>  <Synonyms> (178)
SIRT6-IN-1

>  <Target> (178)
HBV,Sirtuin

>  <Form> (178)
free base

>  <CAS> (178)
887686-02-4

>  <URL> (178)
http://selleckchem.com/products/oss-128167.html

$$$$
LLY-283.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (179)
179

>  <Formula> (179)
C17H18N4O4

>  <MolWeight> (179)
342.34922

>  <Cat> (179)
S8479

>  <Name> (179)
LLY-284

>  <Synonyms> (179)
N/A

>  <Target> (179)
PRMT

>  <Form> (179)
free base

>  <CAS> (179)
2226515-75-7

>  <URL> (179)
https://www.selleckchem.com/products/lly-284.html

$$$$
UNC0642.cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (180)
180

>  <Formula> (180)
C29H44F2N6O2

>  <MolWeight> (180)
546.6954664

>  <Cat> (180)
S7230

>  <Name> (180)
UNC0642

>  <Synonyms> (180)
N/A

>  <Target> (180)
G9a/GLP,Histone Methyltransferase

>  <Form> (180)
free base

>  <CAS> (180)
1481677-78-4

>  <URL> (180)
http://selleckchem.com/products/unc0642.html

$$$$
JQ-EZ-05 (JQEZ5).cdx
csChFnd80/07292609462D

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M  END
>  <Mol_ID> (181)
181

>  <Formula> (181)
C30H38N8O2

>  <MolWeight> (181)
542.67512

>  <Cat> (181)
S8607

>  <Name> (181)
JQ-EZ-05 (JQEZ5)

>  <Synonyms> (181)
N/A

>  <Target> (181)
EZH1/2,Histone Methyltransferase

>  <Form> (181)
free base

>  <CAS> (181)
1913252-04-6

>  <URL> (181)
http://selleckchem.com/products/jq-ez-05-jqez5.html

$$$$
SNS-314.cdx
csChFnd80/07292609462D

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  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  2  1  0  0  0  0
  6 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 13  2  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
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 26 27  2  0  0  0  0
 27 22  1  0  0  0  0
 24 28  1  0  0  0  0
M  END
>  <Mol_ID> (182)
182

>  <Formula> (182)
C18H15ClN6OS2

>  <MolWeight> (182)
430.9343

>  <Cat> (182)
S8699

>  <Name> (182)
SNS-314 Mesylate

>  <Synonyms> (182)
N/A

>  <Target> (182)
Aurora Kinase

>  <Form> (182)
Mesylate

>  <CAS> (182)
1146618-41-8

>  <URL> (182)
http://selleckchem.com/products/sns-314.html

$$$$
S5262 UNC-926.cdx
csChFnd80/07292609462D

 20 22  0  0  0  0  0  0  0  0999 V2000
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    0.0000    4.1067    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.8496    4.1067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    3.4067    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.0067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    1.3067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4869    2.0067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4869    3.4067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.1067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1248    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9575    1.3314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8250    2.1543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6922    1.3314    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8496    5.5067    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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  5  6  2  0  0  0  0
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  1  7  1  0  0  0  0
  8  5  1  0  0  0  0
  9  8  1  0  0  0  0
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 14  9  1  0  0  0  0
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 19 15  1  0  0  0  0
 12 19  1  0  0  0  0
  8 20  2  0  0  0  0
M  END
>  <Mol_ID> (183)
183

>  <Formula> (183)
C16H21BrN2O

>  <MolWeight> (183)
337.25474

>  <Cat> (183)
S5262

>  <Name> (183)
UNC-926

>  <Synonyms> (183)
N/A

>  <Target> (183)
Epigenetic Reader Domain

>  <Form> (183)
free base

>  <CAS> (183)
1184136-10-4

>  <URL> (183)
http://selleckchem.com/products/unc-926.html

$$$$
S5438 Biphenyl-4-sulfonyl chloride.cdx
csChFnd80/07292609462D

 16 17  0  0  0  0  0  0  0  0999 V2000
    4.2000    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8000    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9000    2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9000    0.1876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    0.1876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3000    2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3000    0.1876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    0.1876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0000    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
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 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
M  END
>  <Mol_ID> (184)
184

>  <Formula> (184)
C12H9ClO2S

>  <MolWeight> (184)
252.71666

>  <Cat> (184)
S5438

>  <Name> (184)
Biphenyl-4-sulfonyl chloride

>  <Synonyms> (184)
p-Phenylbenzenesulfonyl chloride, 4-Phenylbenzenesulfonyl chloride, p-Biphenylsulfonyl chloride

>  <Target> (184)
HDAC

>  <Form> (184)
free base

>  <CAS> (184)
1623-93-4

>  <URL> (184)
http://selleckchem.com/products/biphenyl-4-sulfonyl-chloride.html

$$$$
S5445 AMI-1, free acid.cdx
csChFnd80/07292609462D

 34 37  0  0  0  0  0  0  0  0999 V2000
    4.8451    1.9141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8451    3.3142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6309    1.2130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0559    1.2150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6251    4.0186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0602    4.0157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4227    1.9106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2726    1.9176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4226    3.3243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6251    5.4198    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2781    3.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.2118    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    0.5118    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9121    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9117    1.2156    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1240    1.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3353    1.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7606    4.0168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9730    1.9168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9729    3.3169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7606    5.4169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1854    1.2169    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   19.3978    0.5169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.4850    0.0037    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.8850    2.4286    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  2  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  7  9  2  0  0  0  0
  8 13  1  0  0  0  0
  8 11  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  2  0  0  0  0
 12 16  2  0  0  0  0
 13 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 25  1  0  0  0  0
 23 26  2  0  0  0  0
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 25 27  2  0  0  0  0
 26 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27 30  1  0  0  0  0
 28 31  1  0  0  0  0
 28 29  2  0  0  0  0
 31 32  1  0  0  0  0
 31 33  2  0  0  0  0
 31 34  2  0  0  0  0
M  END
>  <Mol_ID> (185)
185

>  <Formula> (185)
C21H16N2O9S2

>  <MolWeight> (185)
504.48974

>  <Cat> (185)
S5445

>  <Name> (185)
AMI-1 (free acid)

>  <Synonyms> (185)
N/A

>  <Target> (185)
Histone Methyltransferase,PRMT

>  <Form> (185)
free base

>  <CAS> (185)
134-47-4

>  <URL> (185)
http://selleckchem.com/products/ami-1-free-acid.html

$$$$
S3934 Acetyl Resveratrol.cdx
csChFnd80/07292609462D

 26 27  0  0  0  0  0  0  0  0999 V2000
    9.6999    5.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7209    4.1569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8708    6.3064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4874    6.3522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8386    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1411    5.5616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2749    5.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1344    4.2179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8386    2.1001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3536    6.2617    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0624    6.3522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0457    1.4032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5685    5.5602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0624    7.7508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8512    5.6529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.0457    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7798    6.2595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5685    4.1587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  1  0  0  0  0
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  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  6  8  2  0  0  0  0
  7 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 11 15  2  0  0  0  0
 12 16  1  0  0  0  0
 12 17  2  0  0  0  0
 13 18  1  0  0  0  0
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 20 22  1  0  0  0  0
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 24 25  1  0  0  0  0
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M  END
>  <Mol_ID> (186)
186

>  <Formula> (186)
C20H18O6

>  <MolWeight> (186)
354.35332

>  <Cat> (186)
S3934

>  <Name> (186)
Acetyl Resveratrol

>  <Synonyms> (186)
N/A

>  <Target> (186)
Others

>  <Form> (186)
free base

>  <CAS> (186)
42206-94-0

>  <URL> (186)
https://www.selleckchem.com/products/acetyl-resveratrol.html

$$$$
S5500 Amodiaquine hydrochloride.cdx
csChFnd80/07292609462D

 27 27  0  0  0  0  0  0  0  0999 V2000
    3.6373    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7078   11.2739    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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 11  2  1  0  0  0  0
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 16  3  1  0  0  0  0
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 12  5  1  0  0  0  0
  6 14  2  0  0  0  0
 17  7  2  0  0  0  0
 18  8  1  0  0  0  0
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 21  9  1  0  0  0  0
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M  END
>  <Mol_ID> (187)
187

>  <Formula> (187)
C20H24Cl3N3O

>  <MolWeight> (187)
428.78306

>  <Cat> (187)
S5500

>  <Name> (187)
Amodiaquine hydrochloride

>  <Synonyms> (187)
N/A

>  <Target> (187)
Immunology & Inflammation related

>  <Form> (187)
dihydrochloride

>  <CAS> (187)
69-44-3

>  <URL> (187)
https://www.selleckchem.com/products/amodiaquine-hydrochloride.html

$$$$
S9432 Ginkgolic Acid.cdx
csChFnd80/07292609462D

 25 25  0  0  0  0  0  0  0  0999 V2000
    2.4156    4.2036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 23 24  1  0  0  0  0
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M  END
>  <Mol_ID> (188)
188

>  <Formula> (188)
C22H34O3

>  <MolWeight> (188)
346.50356

>  <Cat> (188)
S9432

>  <Name> (188)
Ginkgolic Acid

>  <Target> (188)
Histone Acetyltransferase,SUMO

>  <Form> (188)
free base

>  <CAS> (188)
22910-60-7

>  <URL> (188)
https://www.selleckchem.com/products/ginkgolic-acid-s9432.html

$$$$
S9445 Ginkgolic Acid (C130).cdx
csChFnd80/07292609462D

 23 23  0  0  0  0  0  0  0  0999 V2000
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (189)
189

>  <Formula> (189)
C20H32O3

>  <MolWeight> (189)
320.46628

>  <Cat> (189)
S9445

>  <Name> (189)
Ginkgolic Acid (C13:0)

>  <Target> (189)
Histone Acetyltransferase,SUMO

>  <Form> (189)
free base

>  <CAS> (189)
20261-38-5

>  <URL> (189)
https://www.selleckchem.com/products/ginkgolic-acid-s9445.html

$$$$

csChFnd80/07292609462D

 14 13  0  0  0  0  0  0  0  0999 V2000
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    6.0688    2.0840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8542    1.3877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6442    2.0840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (190)
190

>  <Formula> (190)
C8H16N2O4

>  <MolWeight> (190)
204.22364

>  <Cat> (190)
S5905

>  <Name> (190)
Suberohydroxamic acid

>  <Synonyms> (190)
suberic bishydroxamic acid

>  <Target> (190)
HDAC

>  <Form> (190)
Free Base

>  <CAS> (190)
38937-66-5

>  <URL> (190)
http://www.selleckchem.com/products/suberohydroxamic-acid.html

$$$$

csChFnd80/07292609462D

 26 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (191)
191

>  <Formula> (191)
C21H16N2O2S

>  <MolWeight> (191)
360.42894

>  <Cat> (191)
S5913

>  <Name> (191)
Cambinol

>  <Synonyms> (191)
N/A

>  <Target> (191)
Phospholipase (e.g. PLA)

>  <Form> (191)
Free Base

>  <CAS> (191)
14513-15-6

>  <URL> (191)
http://www.selleckchem.com/products/cambinol.html

$$$$

csChFnd80/07292609462D

 26 28  0  0  0  0  0  0  0  0999 V2000
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Sirtuin

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Free Base

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420831-40-9

>  <URL> (192)
http://www.selleckchem.com/products/ak-7.html

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N/A

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Free Base

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901245-65-6

>  <URL> (193)
http://www.selleckchem.com/products/gsk-5959.html

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194

>  <Formula> (194)
C22H15FN4O2S

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N/A

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Sirtuin

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Free Base

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374922-43-7

>  <URL> (194)
http://www.selleckchem.com/products/cay10602.html

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csChFnd80/07292609462D

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N/A

>  <Target> (195)
Epigenetic Reader Domain

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Free Base

>  <CAS> (195)
18228-17-6

>  <URL> (195)
http://www.selleckchem.com/products/kg-501-2-naphthol-as-e-phosphate.html

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csChFnd80/07292609462D

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Free Base

>  <CAS> (196)
1820889-23-3

>  <URL> (196)
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 19 20  2  0  0  0  0
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 23  8  2  0  0  0  0
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 26 20  1  0  0  0  0
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 35 36  1  0  0  0  0
M  END
>  <Mol_ID> (197)
197

>  <Formula> (197)
C28H30FN3O4

>  <MolWeight> (197)
491.5539032

>  <Cat> (197)
S8723

>  <Name> (197)
ABBV-744

>  <Synonyms> (197)
N/A

>  <Target> (197)
Epigenetic Reader Domain

>  <Form> (197)
Free Base

>  <CAS> (197)
2138861-99-9

>  <URL> (197)
http://www.selleckchem.com/products/abbv-744.html

$$$$

csChFnd80/07292609462D

 22 24  0  0  0  0  0  0  0  0999 V2000
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  3  9  1  0  0  0  0
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 20 22  2  0  0  0  0
M  END
>  <Mol_ID> (198)
198

>  <Formula> (198)
C16H16N4O2

>  <MolWeight> (198)
296.32384

>  <Cat> (198)
S8763

>  <Name> (198)
ZL0420

>  <Synonyms> (198)
N/A

>  <Target> (198)
Epigenetic Reader Domain

>  <Form> (198)
Free Base

>  <CAS> (198)
2229039-45-4

>  <URL> (198)
http://www.selleckchem.com/products/zl0420.html

$$$$
S9031 Gambogenic acid.cdx
csChFnd80/07292609462D

 46 50  0  0  0  0  0  0  0  0999 V2000
   12.1266    3.5018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1266    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3438    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   20.2695    7.3033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.8776    8.3708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   18.9351    3.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0601    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8494    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    2.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2107    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0856    9.0715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0856   10.4715    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2982    8.3714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  1  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
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 10  2  1  0  0  0  0
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 13  9  1  0  0  0  0
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 31 32  1  0  0  0  0
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 33 44  1  0  0  0  0
 22 35  1  1  0  0  0
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 36 37  1  0  0  0  0
 36 38  1  0  0  0  0
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  1  2  2  0  0  0  0
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  5 23  1  0  0  0  0
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M  END
>  <Mol_ID> (199)
199

>  <Formula> (199)
C38H46O8

>  <MolWeight> (199)
630.76704

>  <Cat> (199)
S9031

>  <Name> (199)
Gambogenic acid

>  <Target> (199)
EZH1/2,FGFR

>  <Form> (199)
free base

>  <CAS> (199)
173932-75-7

>  <URL> (199)
https://www.selleckchem.com/products/gambogenic-acid.html

$$$$
S9275 Isoguanosine.cdx
csChFnd80/07292609462D

 20 22  0  0  0  0  0  0  0  0999 V2000
    3.6385    5.6609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9701    5.2281    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6385    7.0621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4251    4.9603    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4023    3.8975    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.7930    6.3604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9710    7.4936    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4244    7.7631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2121    5.6607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5757    2.7589    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7082    3.4744    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  6  7  2  0  0  0  0
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 10 15  1  0  0  0  0
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 15 18  1  1  0  0  0
 15 16  1  0  0  0  0
 16 19  1  6  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (200)
200

>  <Formula> (200)
C10H13N5O5

>  <MolWeight> (200)
283.24072

>  <Cat> (200)
S9275

>  <Name> (200)
Isoguanosine

>  <Synonyms> (200)
Crotonoside

>  <Target> (200)
FLT3,HDAC

>  <Form> (200)
free base

>  <CAS> (200)
1818-71-9

>  <URL> (200)
https://www.selleckchem.com/products/isoguanosine.html

$$$$
S9379 Dihydrocoumarin.cdx
csChFnd80/07292609462D

 11 12  0  0  0  0  0  0  0  0999 V2000
    2.4327    0.7057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0016    2.0876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0592    0.0002    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
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M  END
>  <Mol_ID> (201)
201

>  <Formula> (201)
C9H8O2

>  <MolWeight> (201)
148.15862

>  <Cat> (201)
S9379

>  <Name> (201)
Dihydrocoumarin

>  <Target> (201)
Others

>  <Form> (201)
free base

>  <CAS> (201)
119-84-6

>  <URL> (201)
https://www.selleckchem.com/products/dihydrocoumarin.html

$$$$
Tubastatin A hydrochloride.cdx
csChFnd80/07292609462D

 25 28  0  0  0  0  0  0  0  0999 V2000
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    3.6247    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371    1.3927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.0927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4165    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    4.1903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.5578    7.7447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1252    6.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6210    8.7851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2516    8.4940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8190    7.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7557    6.1221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7598    6.1221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6966    7.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2640    8.4940    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8946    8.7851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1975    9.5308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  7 10  2  0  0  0  0
  5 11  1  0  0  0  0
 11 12  1  0  0  0  0
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 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
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 15 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
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 20 16  1  0  0  0  0
 13 21  1  0  0  0  0
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 23 24  1  0  0  0  0
 24 14  1  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (202)
202

>  <Formula> (202)
C20H21N3O2

>  <MolWeight> (202)
335.39964

>  <Cat> (202)
S8049

>  <Name> (202)
Tubastatin A

>  <Target> (202)
Apoptosis related,Autophagy,HDAC

>  <CAS> (202)
1252003-15-8

>  <URL> (202)
https://www.selleckchem.com/products/tubastatin-a.html

$$$$

csChFnd80/07292609462D

 10  9  0  0  0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 S   0  0  3  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    1.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
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  8  9  2  0  0  0  0
  9 10  2  0  0  0  0
M  END
>  <Mol_ID> (203)
203

>  <Formula> (203)
C6H11NOS2

>  <MolWeight> (203)
177.28764

>  <Cat> (203)
S5771

>  <Name> (203)
Sulforaphane

>  <Synonyms> (203)
N/A

>  <Target> (203)
HDAC,Heme Oxygenase,NF-¦ÊB,Nrf2,ROS

>  <Form> (203)
Free Base

>  <CAS> (203)
4478-93-7

>  <URL> (203)
http://www.selleckchem.com/products/sulforaphane.html

$$$$

csChFnd80/07292609462D

 22 24  0  0  0  0  0  0  0  0999 V2000
    8.4868    2.7999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9117    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1241    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1241    2.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9117    2.7999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4868    4.1999    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745    2.0999    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.7999    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8496    2.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.7999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.1999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.8999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.1999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8496    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  2  7  2  0  0  0  0
  9 10  1  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 12 21  2  0  0  0  0
 16 21  1  0  0  0  0
 13 22  1  0  0  0  0
 11 12  1  0  0  0  0
 10 11  2  0  0  0  0
M  END
>  <Mol_ID> (204)
204

>  <Formula> (204)
C17H13N3O2

>  <MolWeight> (204)
291.30402

>  <Cat> (204)
S5772

>  <Name> (204)
AS-8351

>  <Synonyms> (204)
N/A

>  <Target> (204)
Histone Demethylase

>  <Form> (204)
Free Base

>  <CAS> (204)
796-42-9

>  <URL> (204)
http://www.selleckchem.com/products/as-8351.html

$$$$

csChFnd80/07292609462D

 15 15  0  0  0  0  0  0  0  0999 V2000
    4.8976    2.7575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6732    2.0787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6489    0.6789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4245    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2244    0.7209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2487    2.1207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4731    2.7996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9219    4.1573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0977    2.0366    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3221    2.7154    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5222    1.9945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7466    2.6734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9467    1.9525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1711    2.6313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0421    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  2  7  2  0  0  0  0
  9 10  1  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 10 11  1  0  0  0  0
  5 15  1  0  0  0  0
M  END
>  <Mol_ID> (205)
205

>  <Formula> (205)
C11H15BrN2O

>  <MolWeight> (205)
271.1536

>  <Cat> (205)
S5810

>  <Name> (205)
UF010

>  <Synonyms> (205)
N/A

>  <Target> (205)
HDAC

>  <Form> (205)
Free Base

>  <CAS> (205)
537672-41-6

>  <URL> (205)
http://www.selleckchem.com/products/uf010.html

$$$$

csChFnd80/07292609462D

 19 20  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
 14 15  1  0  0  0  0
 11 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
M  END
>  <Mol_ID> (206)
206

>  <Formula> (206)
C15H16N2O2

>  <MolWeight> (206)
256.29974

>  <Cat> (206)
S8773

>  <Name> (206)
TH34

>  <Synonyms> (206)
N/A

>  <Target> (206)
HDAC

>  <Form> (206)
Free Base

>  <CAS> (206)
2196203-96-8

>  <URL> (206)
http://www.selleckchem.com/products/th34.html

$$$$

csChFnd80/07292609462D

 27 29  0  0  0  0  0  0  0  0999 V2000
    0.0000    4.2047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8579    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2827    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9298    3.5572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  5  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  2  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 14  1  0  0  0  0
 17 21  1  0  0  0  0
 19 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 22  1  0  0  0  0
M  END
>  <Mol_ID> (207)
207

>  <Formula> (207)
C18H13F2N3O3S

>  <MolWeight> (207)
389.3759264

>  <Cat> (207)
S8776

>  <Name> (207)
WM-1119

>  <Synonyms> (207)
N/A

>  <Target> (207)
Histone Acetyltransferase

>  <Form> (207)
Free Base

>  <CAS> (207)
2055397-28-7

>  <URL> (207)
http://www.selleckchem.com/products/wm-1119.html

$$$$

csChFnd80/07292609462D

 20 20  0  0  0  0  0  0  0  0999 V2000
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    1.2242    2.0964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    1.3878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (208)
208

>  <Formula> (208)
C12H21N5O3

>  <MolWeight> (208)
283.32684

>  <Cat> (208)
S9472

>  <Name> (208)
Oxtriphylline

>  <Synonyms> (208)
N/A

>  <Target> (208)
PDE Inhibitor, Adenosine receptor, & Histone deacetylase

>  <Form> (208)
Free Base

>  <CAS> (208)
4499-40-5

>  <URL> (208)
N/A

$$$$

csChFnd80/07292609462D

 55 61  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (209)
209

>  <Formula> (209)
C38H37ClN8O7S

>  <MolWeight> (209)
785.26778

>  <Cat> (209)
S8296

>  <Name> (209)
dBET1

>  <Synonyms> (209)
N/A

>  <Target> (209)
Epigenetic Reader Domain,PROTAC

>  <Form> (209)
free base

>  <CAS> (209)
1799711-21-9

>  <URL> (209)
http://www.selleck.cn/products/bet1.html

$$$$

csChFnd80/07292609462D

 59 65  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (210)
210

>  <Formula> (210)
C42H45ClN8O7S

>  <MolWeight> (210)
841.3741

>  <Cat> (210)
S8762

>  <Name> (210)
dBET6

>  <Synonyms> (210)
N/A

>  <Target> (210)
Apoptosis related,Epigenetic Reader Domain,Myc,PROTAC

>  <Form> (210)
free base

>  <CAS> (210)
1950634-92-0

>  <URL> (210)
http://www.selleck.cn/products/dbet6.html

$$$$

csChFnd80/07292609462D

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    3.6373    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5492    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0793    2.1365    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
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M  END
>  <Mol_ID> (211)
211

>  <Formula> (211)
C33H31Cl2N3O5

>  <MolWeight> (211)
620.52234

>  <Cat> (211)
S8846

>  <Name> (211)
compound 3i (666-15)

>  <Synonyms> (211)
N/A

>  <Target> (211)
Epigenetic Reader Domain

>  <Form> (211)
Free Base

>  <CAS> (211)
1433286-70-4

>  <URL> (211)
http://www.selleck.cn/products/compound-3i.html

$$$$

csChFnd80/07292609462D

 31 35  0  0  0  0  0  0  0  0999 V2000
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    8.2737    3.0234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2737    4.4234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0613    5.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5  6  2  0  0  0  0
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  4  7  1  0  0  0  0
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  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
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  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 10  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  6  0  0  0
 15 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 17  1  0  0  0  0
  1 23  1  0  0  0  0
 23 24  1  0  0  0  0
  2 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
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M  END
>  <Mol_ID> (212)
212

>  <Formula> (212)
C23H21N5O3

>  <MolWeight> (212)
415.44454

>  <Cat> (212)
S2780

>  <Name> (212)
I-BET151 (GSK1210151A)

>  <Synonyms> (212)
N/A

>  <Target> (212)
Epigenetic Reader Domain

>  <Form> (212)
Free Base

>  <CAS> (212)
1300031-49-5

>  <URL> (212)
http://www.selleck.cn/products/i-bet151-gsk1210151a.html

$$$$

csChFnd80/07292609462D

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   10.9119    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  2  0  0  0  0
  8 11  2  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 10 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 14 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (213)
213

>  <Formula> (213)
C20H22ClN3O

>  <MolWeight> (213)
355.86118

>  <Cat> (213)
S5948

>  <Name> (213)
Amodiaquine

>  <Synonyms> (213)
N/A

>  <Target> (213)
DNA/RNA Synthesis,Parasite

>  <Form> (213)
Free Base

>  <CAS> (213)
86-42-0

>  <URL> (213)
http://www.selleck.cn/products/amodiaquine.html

$$$$

csChFnd80/07292609462D

 22 23  0  0  0  0  0  0  0  0999 V2000
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    8.4788    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1161    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9037    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3286    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0540    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 15  1  0  0  0  0
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 18 20  1  0  0  0  0
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 20 22  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (214)
214

>  <Formula> (214)
C17H18F2N2O

>  <MolWeight> (214)
304.3344264

>  <Cat> (214)
S2132

>  <Name> (214)
SR-4370

>  <Synonyms> (214)
N/A

>  <Target> (214)
HDAC

>  <Form> (214)
Free Base

>  <CAS> (214)
1816294-67-3

>  <URL> (214)
http://www.selleck.cn/products/sr4370.html

$$$$

csChFnd80/07292609462D

 40 44  0  0  0  0  0  0  0  0999 V2000
    3.1335    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.3459    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5584    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (215)
215

>  <Formula> (215)
C31H39N7O2

>  <MolWeight> (215)
541.68706

>  <Cat> (215)
S7164

>  <Name> (215)
GSK343

>  <Synonyms> (215)
N/A

>  <Target> (215)
Autophagy,EZH1/2,Histone Methyltransferase

>  <Form> (215)
Free Base

>  <CAS> (215)
1346704-33-3

>  <URL> (215)
http://www.selleck.cn/products/gsk343.html

$$$$

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M  END
>  <Mol_ID> (216)
216

>  <Formula> (216)
C26H22N4O3

>  <MolWeight> (216)
438.47788

>  <Cat> (216)
S8739

>  <Name> (216)
PLX51107

>  <Synonyms> (216)
N/A

>  <Target> (216)
Epigenetic Reader Domain

>  <Form> (216)
Free Base

>  <CAS> (216)
1627929-55-8

>  <URL> (216)
http://www.selleck.cn/products/plx51107.html

$$$$

csChFnd80/07292609462D

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 12  7  1  0  0  0  0
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M  END
>  <Mol_ID> (217)
217

>  <Formula> (217)
C19H16N4O3

>  <MolWeight> (217)
348.35534

>  <Cat> (217)
S8753

>  <Name> (217)
INCB054329

>  <Synonyms> (217)
INCB-054329, INCB-54329

>  <Target> (217)
Epigenetic Reader Domain

>  <Form> (217)
Free Base

>  <CAS> (217)
1628607-64-6

>  <URL> (217)
http://www.selleck.cn/products/incb054329.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (218)
218

>  <Formula> (218)
C19H28Cl2N4O2

>  <MolWeight> (218)
415.35722

>  <Cat> (218)
S8769

>  <Name> (218)
Tinostamustine(EDO-S101)

>  <Synonyms> (218)
N/A

>  <Target> (218)
HDAC

>  <Form> (218)
Free Base

>  <CAS> (218)
1236199-60-2

>  <URL> (218)
http://www.selleck.cn/products/tinostamustine.html

$$$$

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   10.1904    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3152    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5277    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1306    6.9748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9277    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2277    3.1249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7735    5.6538    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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  1  7  1  0  0  0  0
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  8  9  1  0  0  0  0
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 14  9  1  0  0  0  0
 15  4  1  1  0  0  0
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 17 15  1  0  0  0  0
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 19 20  1  0  0  0  0
 12 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 20  1  0  0  0  0
M  END
>  <Mol_ID> (219)
219

>  <Formula> (219)
C18H23ClN4O

>  <MolWeight> (219)
346.85442

>  <Cat> (219)
S8438

>  <Name> (219)
T-3775440 HCl

>  <Synonyms> (219)
N/A

>  <Target> (219)
Histone Demethylase,LSD1

>  <Form> (219)
HCl

>  <CAS> (219)
1422535-52-1

>  <URL> (219)
http://www.selleck.cn/products/t-3775440-hcl.html

$$$$

csChFnd80/07292609462D

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   15.7617    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
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 10  5  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
 15 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  2  0  0  0  0
 26 28  1  0  0  0  0
  8 29  1  0  0  0  0
M  END
>  <Mol_ID> (220)
220

>  <Formula> (220)
C21H24N4O4

>  <MolWeight> (220)
396.43966

>  <Cat> (220)
S8743

>  <Name> (220)
SKLB-23bb

>  <Synonyms> (220)
N/A

>  <Target> (220)
HDAC

>  <Form> (220)
free base

>  <CAS> (220)
1815580-06-3

>  <URL> (220)
http://www.selleck.cn/products/sklb-23bb.html

$$$$

csChFnd80/07292609462D

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  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  6  1  0  0  0  0
  1 16  1  0  0  0  0
  2 14  1  0  0  0  0
  5 15  2  0  0  0  0
  6  7  1  0  0  0  0
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  8 11  2  0  0  0  0
  8 12  1  0  0  0  0
  8 13  1  0  0  0  0
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 10 12  2  0  0  0  0
 10 14  1  0  0  0  0
 10 17  1  0  0  0  0
 13 18  2  0  0  0  0
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 16 20  2  0  0  0  0
 16 21  1  0  0  0  0
 18 22  1  0  0  0  0
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 25 27  2  0  0  0  0
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M  END
>  <Mol_ID> (221)
221

>  <Formula> (221)
C20H17FN2O3S

>  <MolWeight> (221)
384.4239832

>  <Cat> (221)
S6655

>  <Name> (221)
WM-8014

>  <Synonyms> (221)
N/A

>  <Target> (221)
Histone Acetyltransferase

>  <Form> (221)
Free Base

>  <CAS> (221)
2055397-18-5

>  <URL> (221)
http://www.selleck.cn/products/wm-8014.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (222)
222

>  <Formula> (222)
C14H16N2O2S

>  <MolWeight> (222)
276.35404

>  <Cat> (222)
S6737

>  <Name> (222)
C7280948

>  <Synonyms> (222)
N/A

>  <Target> (222)
PRMT

>  <Form> (222)
Free Base

>  <CAS> (222)
587850-67-7

>  <URL> (222)
http://www.selleck.cn/products/c7280948.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (223)
223

>  <Formula> (223)
C25H19N5OS2

>  <MolWeight> (223)
469.58126

>  <Cat> (223)
S6744

>  <Name> (223)
Inauhzin

>  <Synonyms> (223)
N/A

>  <Target> (223)
Sirtuin

>  <Form> (223)
Free Base

>  <CAS> (223)
309271-94-1

>  <URL> (223)
http://www.selleck.cn/products/inauhzin.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (224)
224

>  <Formula> (224)
C27H36N2O5

>  <MolWeight> (224)
468.58514

>  <Cat> (224)
S6758

>  <Name> (224)
I-CBP112

>  <Synonyms> (224)
N/A

>  <Target> (224)
Epigenetic Reader Domain

>  <Form> (224)
Free Base

>  <CAS> (224)
1640282-31-0

>  <URL> (224)
http://www.selleck.cn/products/i-cbp112.html

$$$$

csChFnd80/07292609462D

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  4  7  1  0  0  0  0
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M  END
>  <Mol_ID> (225)
225

>  <Formula> (225)
C21H25N3O4

>  <MolWeight> (225)
383.4409

>  <Cat> (225)
S2184

>  <Name> (225)
WDR5-0103

>  <Synonyms> (225)
WD-Repeat Protein 5-0103

>  <Target> (225)
Histone Methyltransferase,WDR5

>  <Form> (225)
Free Base

>  <CAS> (225)
890190-22-4

>  <URL> (225)
http://www.selleck.cn/products/wdr5-0103.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (226)
226

>  <Formula> (226)
C11H15ClN2O5

>  <MolWeight> (226)
290.7002

>  <Cat> (226)
S2935

>  <Name> (226)
Nicotinamide Riboside Chloride

>  <Synonyms> (226)
N/A

>  <Target> (226)
Sirtuin

>  <Form> (226)
Chloride

>  <CAS> (226)
23111-00-4

>  <URL> (226)
http://www.selleck.cn/products/nicotinamide-riboside-chloride.html

$$$$

csChFnd80/07292609462D

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>  <Mol_ID> (227)
227

>  <Formula> (227)
C19H23N3O2

>  <MolWeight> (227)
325.40482

>  <Cat> (227)
S6548

>  <Name> (227)
NKL 22

>  <Synonyms> (227)
N/A

>  <Target> (227)
HDAC

>  <Form> (227)
Free Base

>  <CAS> (227)
537034-15-4

>  <URL> (227)
http://www.selleck.cn/products/nkl-22.html

$$$$

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>  <Mol_ID> (228)
228

>  <Formula> (228)
C21H38N2OS

>  <MolWeight> (228)
366.60422

>  <Cat> (228)
S6687

>  <Name> (228)
SIS17

>  <Synonyms> (228)
N/A

>  <Target> (228)
HDAC

>  <Form> (228)
Free Base

>  <CAS> (228)
2374313-54-7

>  <URL> (228)
http://www.selleck.cn/products/sis17.html

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M  END
>  <Mol_ID> (229)
229

>  <Formula> (229)
C28H38N4O3

>  <MolWeight> (229)
478.62632

>  <Cat> (229)
S8812

>  <Name> (229)
CM272

>  <Synonyms> (229)
N/A

>  <Target> (229)
DNA Methyltransferase

>  <Form> (229)
Free Base

>  <CAS> (229)
1846570-31-7

>  <URL> (229)
http://www.selleck.cn/products/cm272-cm-272.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (230)
230

>  <Formula> (230)
C16H13N3

>  <MolWeight> (230)
247.29452

>  <Cat> (230)
S8909

>  <Name> (230)
UBCS039

>  <Synonyms> (230)
N/A

>  <Target> (230)
Sirtuin

>  <Form> (230)
Free Base

>  <CAS> (230)
358721-70-7

>  <URL> (230)
http://www.selleck.cn/products/ubcs039.html

$$$$

csChFnd80/07292609462D

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  8 11  1  0  0  0  0
  9 10  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
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 15 20  1  0  0  0  0
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 19 24  2  0  0  0  0
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M  END
>  <Mol_ID> (231)
231

>  <Formula> (231)
C26H23N5O2

>  <MolWeight> (231)
437.49312

>  <Cat> (231)
S8961

>  <Name> (231)
Alobresib (GS-5829)

>  <Synonyms> (231)
N/A

>  <Target> (231)
Akt,Apoptosis related,Epigenetic Reader Domain,ERK,Myc,NF-¦ÊB

>  <Form> (231)
Free Base

>  <CAS> (231)
1637771-14-2

>  <URL> (231)
http://www.selleckchem.com/products/alobresib.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (232)
232

>  <Formula> (232)
C15H14FN3O2

>  <MolWeight> (232)
287.2889632

>  <Cat> (232)
S8962

>  <Name> (232)
BRD3308

>  <Synonyms> (232)
N/A

>  <Target> (232)
HDAC

>  <Form> (232)
Free Base

>  <CAS> (232)
1550053-02-5

>  <URL> (232)
http://www.selleckchem.com/products/brd3308.html

$$$$

csChFnd80/07292609462D

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233

>  <Formula> (233)
C17H19N3O2

>  <MolWeight> (233)
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>  <Target> (233)
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Free Base

>  <CAS> (233)
1624117-53-8

>  <URL> (233)
http://www.selleckchem.com/products/xy1.html

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234

>  <Formula> (234)
C20H23ClN4O4S

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450.93902

>  <Cat> (234)
S6722

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>  <Synonyms> (234)
SP-2577 mesylate

>  <Target> (234)
LSD1

>  <Form> (234)
Free Base

>  <CAS> (234)
1423715-37-0

>  <URL> (234)
http://www.selleckchem.com/products/seclidemstat.html

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>  <Mol_ID> (235)
235

>  <Formula> (235)
C14H18BrN3O2

>  <MolWeight> (235)
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>  <Cat> (235)
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>  <Synonyms> (235)
N/A

>  <Target> (235)
SMYD

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432529-82-3

>  <URL> (235)
http://www.selleckchem.com/products/bcl-121.html

$$$$

csChFnd80/07292609462D

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>  <Mol_ID> (236)
236

>  <Formula> (236)
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>  <MolWeight> (236)
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2040291-27-6

>  <URL> (236)
http://www.selleckchem.com/products/lly-283.html

$$$$

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    0.5089    8.6629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2273   10.2461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9642    5.4507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4583    4.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2522    2.6349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1136    5.4168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7366    4.7420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   39.6359    2.4799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3121    4.7249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5163    3.2310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    1.5993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9421    1.8974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.4384    7.6465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.8885    7.6465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.6635    8.3489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 66  1  0  0  0  0
  2 43  1  0  0  0  0
  2 48  1  0  0  0  0
  3 47  1  0  0  0  0
  3 62  1  0  0  0  0
 23  4  1  6  0  0  0
  5 27  2  0  0  0  0
  6 28  2  0  0  0  0
  7 29  2  0  0  0  0
  8 31  1  0  0  0  0
  8 35  1  0  0  0  0
  9 40  1  0  0  0  0
  9 56  1  0  0  0  0
 10 60  1  0  0  0  0
 10 63  1  0  0  0  0
 11 52  2  0  0  0  0
 12 21  1  0  0  0  0
 12 24  1  0  0  0  0
 12 27  1  0  0  0  0
 25 13  1  0  0  0  0
 13 29  1  0  0  0  0
 14 28  1  0  0  0  0
 14 30  1  0  0  0  0
 15 42  1  0  0  0  0
 15 43  1  0  0  0  0
 15 49  1  0  0  0  0
 16 39  1  0  0  0  0
 16 44  2  0  0  0  0
 17 18  1  0  0  0  0
 17 42  2  0  0  0  0
 18 49  2  0  0  0  0
 19 52  1  0  0  0  0
 19 59  1  0  0  0  0
 20 53  1  0  0  0  0
 20 62  2  0  0  0  0
 21 22  1  0  0  0  0
 21 28  1  1  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 25 26  1  1  0  0  0
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 29 31  1  0  0  0  0
 30 32  1  0  0  0  0
 32 33  2  0  0  0  0
 32 34  1  0  0  0  0
 33 36  1  0  0  0  0
 34 37  2  0  0  0  0
 35 40  1  0  0  0  0
 36 38  2  0  0  0  0
 37 38  1  0  0  0  0
 38 47  1  0  0  0  0
 39 42  1  0  0  0  0
 39 46  1  6  0  0  0
 41 43  2  0  0  0  0
 41 44  1  0  0  0  0
 41 45  1  0  0  0  0
 44 50  1  0  0  0  0
 45 48  2  0  0  0  0
 45 51  1  0  0  0  0
 46 52  1  0  0  0  0
 47 53  2  0  0  0  0
 48 54  1  0  0  0  0
 49 55  1  0  0  0  0
 50 57  2  0  0  0  0
 50 58  1  0  0  0  0
 53 61  1  0  0  0  0
 56 60  1  0  0  0  0
 57 64  1  0  0  0  0
 58 65  2  0  0  0  0
 59 63  1  0  0  0  0
 64 66  2  0  0  0  0
 65 66  1  0  0  0  0
 26 67  1  0  0  0  0
 26 68  1  0  0  0  0
 26 69  1  0  0  0  0
M  END
>  <Mol_ID> (237)
237

>  <Formula> (237)
C49H60ClN9O8S2

>  <MolWeight> (237)
1002.6392

>  <Cat> (237)
S8889

>  <Name> (237)
MZ-1

>  <Synonyms> (237)
N/A

>  <Target> (237)
Epigenetic Reader Domain,PROTAC

>  <Form> (237)
Free Base

>  <CAS> (237)
1797406-69-9

>  <URL> (237)
http://www.selleckchem.com/products/mz-1.html

$$$$

csChFnd80/07292609462D

 29 30  0  0  0  0  0  0  0  0999 V2000
    0.0000   11.2000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4248   14.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.8248   12.6000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.0248   12.6000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 25  1  0  0  0  0
  2 28  1  0  0  0  0
  3 28  1  0  0  0  0
  4 28  1  0  0  0  0
  5 11  1  0  0  0  0
  5 13  1  0  0  0  0
  6 14  1  0  0  0  0
  6 26  1  0  0  0  0
  7 15  2  0  0  0  0
  8 10  1  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
  9 15  1  0  0  0  0
  9 17  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 14 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 22  2  0  0  0  0
 17 24  1  0  0  0  0
 18 19  2  0  0  0  0
 22 23  1  0  0  0  0
 23 25  2  0  0  0  0
 23 28  1  0  0  0  0
 24 27  2  0  0  0  0
 25 27  1  0  0  0  0
 26 29  1  0  0  0  0
M  END
>  <Mol_ID> (238)
238

>  <Formula> (238)
C20H22ClF3N2O3

>  <MolWeight> (238)
430.8484896

>  <Cat> (238)
S0022

>  <Name> (238)
YF-2

>  <Synonyms> (238)
N/A

>  <Target> (238)
Epigenetic Reader Domain,Histone Acetyltransferase

>  <Form> (238)
free base

>  <CAS> (238)
1311423-89-8

>  <URL> (238)
http://www.selleckchem.com/products/yf-2.html

$$$$

csChFnd80/07292609462D

 49 55  0  0  0  0  0  0  0  0999 V2000
    6.4285   10.4507    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.3707    3.9192    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.8020    5.2106    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.9316    4.3512    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.0833    2.7837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.9029    9.2082    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1796    4.1486    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1276    4.3347    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2614    2.3329    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.9198    6.7826    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8549    4.1314    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.0442    2.7691    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6351    0.5336    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3959    2.0468    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3170    0.0729    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.8275    5.5468    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   17.1107    6.7603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8034    7.9822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4619    2.8090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7449    4.1763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7698    2.7455    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   19.2318    5.5633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6838    2.1164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7115    3.0615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6068    1.9295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4305    4.8582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7380    3.6362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2405    2.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9716    2.0516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2030    7.9961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8178    5.0786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4854    5.8860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6950    0.7119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4697    1.1656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2121    5.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8170    2.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2622    0.6926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1796    2.7490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6184    2.7526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4841    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2197    6.4192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7633    7.2578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0705    1.1656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.0018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2562    7.4412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5867    6.7426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6597    8.7866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9899    8.0879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0266    9.1100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 49  1  0  0  0  0
  2 27  1  0  0  0  0
  2 35  1  0  0  0  0
  3 20  2  0  0  0  0
  4 22  2  0  0  0  0
  5 24  2  0  0  0  0
  6 30  2  0  0  0  0
  7 38  2  0  0  0  0
  8 16  1  0  0  0  0
  8 20  1  0  0  0  0
  8 24  1  0  0  0  0
  9 25  1  0  0  0  0
  9 27  1  0  0  0  0
  9 34  1  0  0  0  0
 10 22  1  0  0  0  0
 10 30  1  0  0  0  0
 11 21  1  0  0  0  0
 11 31  2  0  0  0  0
 12 28  1  0  0  0  0
 12 36  1  0  0  0  0
 13 15  1  0  0  0  0
 13 25  2  0  0  0  0
 14 38  1  0  0  0  0
 14 39  1  0  0  0  0
 15 34  2  0  0  0  0
 16 17  1  0  0  0  0
 16 22  1  0  0  0  0
 17 18  1  0  0  0  0
 18 30  1  0  0  0  0
 19 20  1  0  0  0  0
 19 23  2  0  0  0  0
 19 28  1  0  0  0  0
 21 25  1  0  0  0  0
 21 29  1  1  0  0  0
 23 24  1  0  0  0  0
 23 33  1  0  0  0  0
 26 27  2  0  0  0  0
 26 31  1  0  0  0  0
 26 32  1  0  0  0  0
 28 37  2  0  0  0  0
 29 38  1  0  0  0  0
 31 41  1  0  0  0  0
 32 35  2  0  0  0  0
 32 42  1  0  0  0  0
 33 40  2  0  0  0  0
 34 43  1  0  0  0  0
 35 44  1  0  0  0  0
 36 39  1  0  0  0  0
 37 40  1  0  0  0  0
 41 45  2  0  0  0  0
 41 46  1  0  0  0  0
 45 47  1  0  0  0  0
 46 48  2  0  0  0  0
 47 49  2  0  0  0  0
 48 49  1  0  0  0  0
M  END
>  <Mol_ID> (239)
239

>  <Formula> (239)
C34H31ClN8O5S

>  <MolWeight> (239)
699.17854

>  <Cat> (239)
S0137

>  <Name> (239)
dBET57

>  <Synonyms> (239)
N/A

>  <Target> (239)
Epigenetic Reader Domain,PROTAC

>  <Form> (239)
free base

>  <CAS> (239)
1883863-52-2

>  <URL> (239)
http://www.selleckchem.com/products/dbet57.html

$$$$

csChFnd80/07292609462D

 22 24  0  0  0  0  0  0  0  0999 V2000
   10.9279    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.8746    2.0989    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0867    2.7986    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8776    4.9005    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2983    0.7018    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4496    2.0989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6621    2.7989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6621    4.1988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2131    2.8128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4496    0.7264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4496    4.8988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2372    0.0264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2983    2.0991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4496    6.2999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6627    7.0002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8776    6.3022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5046    2.7955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7156    2.0964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7156    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5096    0.0025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 21  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3 15  1  0  0  0  0
  4  8  1  0  0  0  0
  4 18  2  0  0  0  0
  5 15  2  0  0  0  0
  5 22  1  0  0  0  0
  6  7  1  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  7  8  1  0  0  0  0
  8 11  2  0  0  0  0
  9 12  1  0  0  0  0
 10 13  2  0  0  0  0
 11 16  1  0  0  0  0
 12 14  2  0  0  0  0
 13 14  1  0  0  0  0
 15 19  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (240)
240

>  <Formula> (240)
C17H13ClN4

>  <MolWeight> (240)
308.76492

>  <Cat> (240)
S0201

>  <Name> (240)
Z-JIB-04 (NSC 693627)

>  <Synonyms> (240)
JIB-04 Z-isomer, (Z)-JIB-04

>  <Target> (240)
Histone Demethylase,JMJD

>  <Form> (240)
free base

>  <CAS> (240)
199596-24-2

>  <URL> (240)
http://www.selleckchem.com/products/z-jib-04-nsc-693627.html

$$$$

csChFnd80/07292609462D

 25 27  0  0  0  0  0  0  0  0999 V2000
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    8.3888    4.8151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9582    3.5361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.8827    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0905    0.9830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  2  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
  8 13  2  0  0  0  0
  1 13  1  0  0  0  0
 14 15  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 16 17  1  0  0  0  0
 15 16  1  0  0  0  0
  1 14  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
  5 20  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
 10 23  1  0  0  0  0
M  END
>  <Mol_ID> (241)
241

>  <Formula> (241)
C21H24N2O2

>  <MolWeight> (241)
336.42746

>  <Cat> (241)
S0507

>  <Name> (241)
CBL0137

>  <Synonyms> (241)
Curaxin-137, CBL-C137, CBLC137

>  <Target> (241)
NF-¦ÊB,p53

>  <Form> (241)
free base

>  <CAS> (241)
1197996-80-7

>  <URL> (241)
http://www.selleckchem.com/products/cbl-0137.html

$$$$

csChFnd80/07292609462D

 32 34  0  0  0  0  0  0  0  0999 V2000
    5.2325    2.3255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5325    3.5379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1325    3.5379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4325    2.3255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1325    1.1131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.8325    5.6923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.5137    4.0026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7261    4.7026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3055    4.7001    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   15.5137    2.6074    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   14.3055    3.3050    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   16.7261    6.0977    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.9344    4.0050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  3  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13  9  1  0  0  0  0
 12 14  1  0  0  0  0
  7 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 16  1  0  0  0  0
 19 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 22 25  2  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  0  0  0  0
 26 30  1  0  0  0  0
 27 31  2  0  0  0  0
 27 32  1  0  0  0  0
M  END
>  <Mol_ID> (242)
242

>  <Formula> (242)
C22H22F3N3O4

>  <MolWeight> (242)
449.4229896

>  <Cat> (242)
S0709

>  <Name> (242)
Tubastatin A TFA

>  <Synonyms> (242)
Tubastatin A trifluoroacetate salt

>  <Target> (242)
Apoptosis related,Autophagy,HDAC

>  <Form> (242)
trifluoroacetate

>  <CAS> (242)
1239262-52-2

>  <URL> (242)
http://www.selleckchem.com/products/tubastatin-a-tfa.html

$$$$

csChFnd80/07292609462D

 23 24  0  0  0  0  0  0  0  0999 V2000
    6.0622    4.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    5.4124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    4.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    3.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  2  7  2  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
 10 11  1  0  0  0  0
 10 13  1  0  0  0  0
 10 12  1  0  0  0  0
  5 10  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 17 22  2  0  0  0  0
 15 17  1  0  0  0  0
 20 23  1  0  0  0  0
  9 14  1  0  0  0  0
M  END
>  <Mol_ID> (243)
243

>  <Formula> (243)
C18H21N3OS

>  <MolWeight> (243)
327.44384

>  <Cat> (243)
S2176

>  <Name> (243)
Tenovin-3

>  <Synonyms> (243)
N/A

>  <Target> (243)
p53,Sirtuin

>  <Form> (243)
free base

>  <CAS> (243)
1011301-27-1

>  <URL> (243)
http://www.selleckchem.com/products/tenovin-3.html

$$$$

csChFnd80/07292609462D

 25 27  0  0  0  0  0  0  0  0999 V2000
    1.2082    3.4951    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2082    2.0951    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.4207    1.3951    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.6331    2.0951    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6331    3.4951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.1951    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4207    5.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.3976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  8  1  1  0  0  0
  4  9  1  1  0  0  0
  1 10  1  6  0  0  0
  3 11  1  6  0  0  0
  9 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 14 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
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 21 24  2  0  0  0  0
  7 25  1  0  0  0  0
M  END
>  <Mol_ID> (244)
244

>  <Formula> (244)
C16H18O9

>  <MolWeight> (244)
354.30872

>  <Cat> (244)
S3262

>  <Name> (244)
Scopolin

>  <Synonyms> (244)
N/A

>  <Target> (244)
Sirtuin

>  <Form> (244)
free base

>  <CAS> (244)
531-44-2

>  <URL> (244)
http://www.selleckchem.com/products/scopolin.html

$$$$

csChFnd80/07292609462D

 36 40  0  0  0  0  0  0  0  0999 V2000
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   12.3185    3.6765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6879    3.9676    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    2.4249    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    4.8497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.0622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    7.2746    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    7.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6279    2.9236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0021    3.2157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4362    4.5518    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.4962    5.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1220    5.3037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  2  7  2  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 10 15  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 16 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 17 21  2  0  0  0  0
 18 23  1  0  0  0  0
 24 25  1  0  0  0  0
 19 24  1  0  0  0  0
 11 22  1  0  0  0  0
  9 10  1  0  0  0  0
 26 27  1  0  0  0  0
  6 26  1  0  0  0  0
 28 29  1  0  0  0  0
  5 28  1  0  0  0  0
 30 31  1  0  0  0  0
  4 30  1  0  0  0  0
 25 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 25  1  0  0  0  0
M  END
>  <Mol_ID> (245)
245

>  <Formula> (245)
C26H29N5O4S

>  <MolWeight> (245)
507.60456

>  <Cat> (245)
S6880

>  <Name> (245)
SRT-1460

>  <Synonyms> (245)
N/A

>  <Target> (245)
Sirtuin

>  <Form> (245)
free base

>  <CAS> (245)
925432-73-1

>  <URL> (245)
http://www.selleckchem.com/products/srt-1460.html

$$$$

csChFnd80/07292609462D

 10 11  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7564    0.2674    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5793    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7564    2.5326    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1875    3.8595    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  9 10  1  0  0  0  0
M  END
>  <Mol_ID> (246)
246

>  <Formula> (246)
C6H6N4

>  <MolWeight> (246)
134.13864

>  <Cat> (246)
S6886

>  <Name> (246)
1-Aminobenzotriazole

>  <Synonyms> (246)
ABT, 3-Aminobenzotriazole, 1-Benzotriazolylamine, NSC 114498, NSC 656987

>  <Target> (246)
Histone Acetyltransferase,P450 (e.g. CYP17),Transferase

>  <Form> (246)
free base

>  <CAS> (246)
1614-12-6

>  <URL> (246)
http://www.selleckchem.com/products/1-aminobenzotriazole.html

$$$$

csChFnd80/07292609462D

 36 40  0  0  0  0  0  0  0  0999 V2000
    1.2120    4.1116    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2120    2.7110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6387    2.7120    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6387    4.0994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4209    4.8096    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4209    6.2068    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2755    4.8071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0648    4.1081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0648    2.7071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2782    2.0066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8560    2.0092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8560    0.6033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2755    6.2028    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4932    6.9058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6424    3.4245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    4.8113    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6167    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  1  0  0  0
 16  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 17  1  0  0  0  0
 10 12  1  0  0  0  0
 12  4  1  0  0  0  0
 12 13  2  0  0  0  0
  8 14  1  0  0  0  0
 14 15  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 16  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  2  0  0  0  0
 23 26  1  0  0  0  0
 25 24  1  0  0  0  0
 24 21  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 25  1  0  0  0  0
 24 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 32  1  0  0  0  0
  1 35  1  1  0  0  0
M  END
>  <Mol_ID> (247)
247

>  <Formula> (247)
C27H32ClN5O3

>  <MolWeight> (247)
510.02768

>  <Cat> (247)
S7803

>  <Name> (247)
GSK484 HCl

>  <Synonyms> (247)
GSK484 hydrochloride

>  <Target> (247)
PAD

>  <Form> (247)
hydrochloride

>  <CAS> (247)
1652591-81-5

>  <URL> (247)
http://www.selleckchem.com/products/gsk484-hcl.html

$$$$

csChFnd80/07292609462D

 32 36  0  0  0  0  0  0  0  0999 V2000
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   10.3099    7.0146    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.7044    7.0146    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4182    4.3694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2105    5.0666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4182    2.9766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6368    5.0730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.3677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2144    2.2666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    5.0812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8423    4.3770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    6.4898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2088    5.8003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.7132    4.5897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.4008    5.8084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.4097    3.3835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3 18  1  0  0  0  0
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  7 32  1  0  0  0  0
  8  9  1  0  0  0  0
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  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 16  1  0  0  0  0
 14 16  2  0  0  0  0
 14 17  1  0  0  0  0
 15 20  1  0  0  0  0
 15 21  1  1  0  0  0
 17 19  2  0  0  0  0
 18 22  1  0  0  0  0
 20 23  2  0  0  0  0
 20 24  1  0  0  0  0
 22 25  1  0  0  0  0
 23 27  1  0  0  0  0
 24 28  2  0  0  0  0
 25 26  2  0  0  0  0
 26 29  1  0  0  0  0
 26 31  1  0  0  0  0
 27 30  2  0  0  0  0
 28 30  1  0  0  0  0
M  END
>  <Mol_ID> (248)
248

>  <Formula> (248)
C25H27N5O2

>  <MolWeight> (248)
429.51418

>  <Cat> (248)
S8574

>  <Name> (248)
BI 894999

>  <Synonyms> (248)
N/A

>  <Target> (248)
Epigenetic Reader Domain

>  <Form> (248)
free base

>  <CAS> (248)
1660117-38-3

>  <URL> (248)
http://www.selleckchem.com/products/bi894999.html

$$$$

csChFnd80/07292609462D

 53 60  0  0  0  0  0  0  0  0999 V2000
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 53 51  1  0  0  0  0
M  END
>  <Mol_ID> (249)
249

>  <Formula> (249)
C42H54N8O3

>  <MolWeight> (249)
718.92996

>  <Cat> (249)
S8918

>  <Name> (249)
MS1943

>  <Synonyms> (249)
N/A

>  <Target> (249)
Histone Methyltransferase

>  <Form> (249)
free base

>  <CAS> (249)
2225938-17-8

>  <URL> (249)
http://www.selleckchem.com/products/ms1943.html

$$$$

csChFnd80/07292609462D

 31 34  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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  4  7  1  0  0  0  0
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  8  9  2  0  0  0  0
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  2 10  1  0  0  0  0
  8 11  1  0  0  0  0
  7 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 11 16  1  0  0  0  0
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 25 10  1  0  0  0  0
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M  END
>  <Mol_ID> (250)
250

>  <Formula> (250)
C22H24F3N3O3

>  <MolWeight> (250)
435.4394696

>  <Cat> (250)
S9648

>  <Name> (250)
NEO2734

>  <Synonyms> (250)
EP31670

>  <Target> (250)
Epigenetic Reader Domain,Histone Acetyltransferase

>  <Form> (250)
free base

>  <CAS> (250)
2081072-29-7

>  <URL> (250)
http://www.selleckchem.com/products/neo2734.html

$$$$

csChFnd80/07292609462D

 69 76  0  0  0  0  0  0  0  0999 V2000
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 26 27  1  0  0  0  0
  1 62  1  0  0  0  0
 27 28  1  0  0  0  0
  1 63  1  0  0  0  0
 28 29  1  0  0  0  0
 19 64  1  0  0  0  0
  1  2  1  0  0  0  0
 19 65  1  0  0  0  0
 29 30  1  6  0  0  0
 61 66  1  0  0  0  0
  1  4  1  0  0  0  0
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 30 31  1  0  0  0  0
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 31 32  1  0  0  0  0
 68 69  1  0  0  0  0
M  END
>  <Mol_ID> (251)
251

>  <Formula> (251)
C47H76O16

>  <MolWeight> (251)
897.09674

>  <Cat> (251)
S9262

>  <Name> (251)
Raddeanin A

>  <Synonyms> (251)
Raddeanin R3, NSC382873

>  <Target> (251)
HDAC

>  <Form> (251)
Free Base

>  <CAS> (251)
89412-79-3

>  <URL> (251)
https://www.selleckchem.com/products/raddeanin-a.html

$$$$

csChFnd80/07292609462D

 25 27  0  0  0  0  0  0  0  0999 V2000
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    4.8497    7.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2040    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3870    3.9266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8218    5.2574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 22  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  2  0  0  0  0
  2  8  1  0  0  0  0
  2 14  1  0  0  0  0
  3  9  1  0  0  0  0
  3 13  1  0  0  0  0
  4 15  1  0  0  0  0
  4 24  1  0  0  0  0
  7 18  1  0  0  0  0
  7 25  1  0  0  0  0
  8 10  1  0  0  0  0
  9 17  2  0  0  0  0
 10 12  1  0  0  0  0
 10 15  2  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 11 17  1  0  0  0  0
 13 16  2  0  0  0  0
 14 18  2  0  0  0  0
 14 19  1  0  0  0  0
 15 16  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  2  0  0  0  0
 21 23  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (252)
252

>  <Formula> (252)
C16H15BrN2O5S

>  <MolWeight> (252)
427.2697

>  <Cat> (252)
S0344

>  <Name> (252)
Y06036

>  <Synonyms> (252)
N/A

>  <Target> (252)
Epigenetic Reader Domain

>  <Form> (252)
Free Base

>  <CAS> (252)
1832671-96-1

>  <URL> (252)
https://www.selleckchem.com/products/y06036.html

$$$$

csChFnd80/07292609462D

 24 27  0  0  0  0  0  0  0  0999 V2000
    4.9064    4.5792    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.1174    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9175    4.1908    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3682    3.0054    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.9940    1.6185    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4605    4.0816    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2064    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2475    1.3263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8188    1.6185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7738    3.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3523    4.0816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6064    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0390    3.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.3016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5653    1.3263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4446    3.0054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8128    3.3016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7536    2.2650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2404    4.6348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1218    2.5614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6085    4.9312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5493    3.8944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0625    1.5245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0359    6.2642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1 13  1  0  0  0  0
  2 15  2  0  0  0  0
  3 22  1  0  0  0  0
  4  9  1  0  0  0  0
  4 11  1  0  0  0  0
  4 14  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6 13  1  0  0  0  0
  6 16  2  0  0  0  0
  7  8  1  0  0  0  0
  7 10  2  0  0  0  0
  7 12  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  2  0  0  0  0
 12 15  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 20 23  1  0  0  0  0
 21 22  1  0  0  0  0
 21 24  1  0  0  0  0
M  END
>  <Mol_ID> (253)
253

>  <Formula> (253)
C18H19N3O2S

>  <MolWeight> (253)
341.42736

>  <Cat> (253)
S1027

>  <Name> (253)
FL-411

>  <Synonyms> (253)
BRD4-IN-1

>  <Target> (253)
Autophagy,Epigenetic Reader Domain

>  <Form> (253)
Free Base

>  <CAS> (253)
2118944-88-8

>  <URL> (253)
https://www.selleckchem.com/products/fl-411.html

$$$$

csChFnd80/07292609462D

 25 27  0  0  0  0  0  0  0  0999 V2000
    9.6995    9.8000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   12.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 20  1  0  0  0  0
  2 21  1  0  0  0  0
  3 11  2  0  0  0  0
  4 24  1  0  0  0  0
  5 25  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 12  2  0  0  0  0
 10 11  1  0  0  0  0
 10 13  2  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  2  0  0  0  0
 14 18  1  0  0  0  0
 15 17  2  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  2  0  0  0  0
 19 23  2  0  0  0  0
 20 24  2  0  0  0  0
 21 25  2  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (254)
254

>  <Formula> (254)
C20H16Br2O3

>  <MolWeight> (254)
464.14724

>  <Cat> (254)
S1161

>  <Name> (254)
Histone?Acetyltransferase?Inhibitor?II

>  <Synonyms> (254)
HAT Inhibitor II

>  <Target> (254)
Epigenetic Reader Domain,Histone Acetyltransferase

>  <Form> (254)
Free Base

>  <CAS> (254)
932749-62-7

>  <URL> (254)
https://www.selleckchem.com/products/histone-acetyltransferase-inhibitor-ii.html

$$$$

csChFnd80/07292609462D

 19 21  0  0  0  0  0  0  0  0999 V2000
    3.6089    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.3089    7.7544    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.6555   10.1660    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0862    8.8870    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4763    6.4230    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   12.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1326   13.4529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4326   11.2986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2652   12.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8326   11.2986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9089    7.7544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6089    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6089    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7417    6.4230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8215    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3965    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8215    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3965    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6089    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 19  1  0  0  0  0
  2 11  1  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3 10  2  0  0  0  0
  4 11  1  0  0  0  0
  5 11  2  0  0  0  0
  5 12  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 10  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (255)
255

>  <Formula> (255)
C14H14ClN3S

>  <MolWeight> (255)
291.79906

>  <Cat> (255)
S1242

>  <Name> (255)
CPTH2

>  <Synonyms> (255)
N/A

>  <Target> (255)
Apoptosis related,Histone Acetyltransferase

>  <Form> (255)
Free Base

>  <CAS> (255)
357649-93-5

>  <URL> (255)
https://www.selleckchem.com/products/cpth2.html

$$$$

csChFnd80/07292609462D

 29 31  0  0  0  0  0  0  0  0999 V2000
   13.3371    6.3001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9123    6.3001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9123    3.5001    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2126    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5495    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1247    4.2001    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   14.5495    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7621    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371    7.7002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4697    8.5231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2045    8.5231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1247    5.6001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0371    9.8545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6371    9.8545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6997    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0624    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0624    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  1  0  0  0  0
  1 18  1  0  0  0  0
  2 18  2  0  0  0  0
  3 29  2  0  0  0  0
  4  7  1  0  0  0  0
 11  5  1  6  0  0  0
  5 21  1  0  0  0  0
  6 24  1  0  0  0  0
  6 26  2  0  0  0  0
  7 29  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 18  1  0  0  0  0
 12 14  1  0  0  0  0
 13 14  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 19 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (256)
256

>  <Formula> (256)
C22H33N3O4

>  <MolWeight> (256)
403.51512

>  <Cat> (256)
S1313

>  <Name> (256)
GSK3117391

>  <Synonyms> (256)
GSK3117391A, HDAC-IN-3

>  <Target> (256)
HDAC

>  <Form> (256)
Free Base

>  <CAS> (256)
1018673-42-1

>  <URL> (256)
https://www.selleckchem.com/products/gsk3117391.html

$$$$

csChFnd80/07292609462D

 12  9  0  0  0  0  0  0  0  0999 V2000
   10.7932    1.4389    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4389    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    7.0781    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5031    1.4000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    8.2907    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2284    1.4000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.4408    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8657    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0781    1.4000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.6533    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2907    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4408    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  9  3  1  1  0  0  0
  4 11  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 12  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
M  END
>  <Mol_ID> (257)
257

>  <Formula> (257)
C5H6Na2O5

>  <MolWeight> (257)
192.07768

>  <Cat> (257)
S1325

>  <Name> (257)
L-2-Hydroxyglutaric acid disodium

>  <Synonyms> (257)
(S)-2-Hydroxyglutaric acid disodium, L-2-Hydroxyglutarate disodium, LGA, L-2HG

>  <Target> (257)
Histone Demethylase

>  <Form> (257)
Disodium

>  <CAS> (257)
63512-50-5

>  <URL> (257)
https://www.selleckchem.com/products/l-2-hydroxyglutaric-acid-disodium.html

$$$$

csChFnd80/07292609462D

 26 28  0  0  0  0  0  0  0  0999 V2000
   10.1550    5.8533    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.4912    6.2777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7139    4.5246    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.3391    6.9910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4957    7.6777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6999    5.5748    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3784    4.0980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5299    3.3748    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.1690    8.1185    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.7168    8.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9106    6.2687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3733    2.7002    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.7000    2.2594    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.9298    3.3748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   12.7168    9.7748    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.1238    0.9251    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4125    1.3929    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.1357    1.9671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5536    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.1485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9946    3.3600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  1  1  1  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  5  9  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  6  0  0  0
 10 15  2  0  0  0  0
 10 16  1  0  0  0  0
 11 15  1  0  0  0  0
 12 17  1  1  0  0  0
 12 13  1  0  0  0  0
 13 18  1  6  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  6  0  0  0
 23 25  1  0  0  0  0
 23 26  2  0  0  0  0
M  END
>  <Mol_ID> (258)
258

>  <Formula> (258)
C14H20N6O5S

>  <MolWeight> (258)
384.4108

>  <Cat> (258)
S7868

>  <Name> (258)
S-Adenosyl-L-homocysteine (SAH)

>  <Synonyms> (258)
S-Adenosylhomocysteine, AdoHcy, Formycinylhomocysteine

>  <Target> (258)
Histone Methyltransferase

>  <Form> (258)
Free Base

>  <CAS> (258)
979-92-0

>  <URL> (258)
https://www.selleckchem.com/products/s-adenosyl-l-homocysteine.html

$$$$

csChFnd80/07292609462D

 24 26  0  0  0  0  0  0  0  0999 V2000
    4.8550    3.4539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0987    4.1719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3103    3.4724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3103    2.0942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1007    1.3959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8724    2.1050    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0987    5.5914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2955    6.2824    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8593    6.3070    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    8.5531    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7967    2.0947    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6483    1.3982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6484    4.1505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8593    7.7012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0016    1.3990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4124    1.3990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7124    0.1866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  2  7  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
  4 10  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 14 19  2  0  0  0  0
 13 14  1  0  0  0  0
  6 13  1  0  0  0  0
  1 20  2  0  0  0  0
  9 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 22 24  1  0  0  0  0
 12 22  1  0  0  0  0
M  END
>  <Mol_ID> (259)
259

>  <Formula> (259)
C18H19N3O3

>  <MolWeight> (259)
325.36176

>  <Cat> (259)
S9685

>  <Name> (259)
GSK620

>  <Synonyms> (259)
N/A

>  <Target> (259)
Epigenetic Reader Domain

>  <Form> (259)
Free Base

>  <CAS> (259)
2088410-46-0

>  <URL> (259)
http://www.selleckchem.com/products/gsk620.html

$$$$

csChFnd80/07292609462D

 39 44  0  0  0  0  0  0  0  0999 V2000
    3.4240    6.7538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4240    5.3538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6364    4.6538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8488    5.3538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8488    6.7538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6364    7.4538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1803    4.9211    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0032    6.0538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1803    7.1864    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6114    8.5132    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.9809    8.8043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4135   10.1358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4767   11.1762    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.1073   10.8851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6747    9.5536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9078   12.5031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2601   12.8654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2157    4.6562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9368    5.2256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0694    3.2639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1062    2.3303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6467    6.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3984    6.0538    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.0984    4.8413    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.4984    4.8413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1984    6.0538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4984    7.2662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0984    7.2662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4008    3.6331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.1008    2.4207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1959    3.6331    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9057    2.4207    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.3032    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
 10  9  1  1  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 10  1  0  0  0  0
 13 16  1  6  0  0  0
 16 17  1  0  0  0  0
  2 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 18  2  0  0  0  0
 22 23  1  0  0  0  0
 19 24  1  0  0  0  0
 25  8  1  6  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 25  1  0  0  0  0
 26 31  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 31  1  0  0  0  0
 27 37  2  0  0  0  0
 33 38  1  0  0  0  0
 34 39  1  0  0  0  0
M  END
>  <Mol_ID> (260)
260

>  <Formula> (260)
C30H32F2N4O3

>  <MolWeight> (260)
534.5968864

>  <Cat> (260)
S9667

>  <Name> (260)
Inobrodib (CCS-1477)

>  <Synonyms> (260)
CBP-IN-1, CBP/p300-IN-4

>  <Target> (260)
Androgen Receptor,Epigenetic Reader Domain,Myc

>  <Form> (260)
Free Base

>  <CAS> (260)
2222941-37-7

>  <URL> (260)
http://www.selleckchem.com/products/ccs-1477-cbp-in-1-.html

$$$$

csChFnd80/07292609462D

 40 46  0  0  0  0  0  0  0  0999 V2000
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    0.0000   10.5004    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    9.8004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249   10.5004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249   11.9004    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   12.6004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   12.6004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497   11.9004    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   12.6004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   14.0004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373   14.0004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  6  1  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12  7  2  0  0  0  0
 11 13  2  0  0  0  0
  9 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 10  1  0  0  0  0
 14 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 17  1  0  0  0  0
 20 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 24  1  0  0  0  0
 26 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 34 30  1  0  0  0  0
 32 35  1  0  0  0  0
 33 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
 40 37  1  0  0  0  0
M  END
>  <Mol_ID> (261)
261

>  <Formula> (261)
C29H29N7O3S

>  <MolWeight> (261)
555.65066

>  <Cat> (261)
S8948

>  <Name> (261)
SRX3207

>  <Synonyms> (261)
N/A

>  <Target> (261)
Epigenetic Reader Domain,PI3K,Syk

>  <Form> (261)
Free Base

>  <CAS> (261)
2254693-15-5

>  <URL> (261)
http://www.selleckchem.com/products/srx3207.html

$$$$

csChFnd80/07292609462D

 30 32  0  0  0  0  0  0  0  0999 V2000
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    6.0496    2.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2620    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4744    2.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4744    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2620    4.8951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    4.8927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    4.1951    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4249    4.8927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827    4.8927    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.2620    6.2903    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4702    6.9879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6784    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4702    8.3830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1033    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1033    2.1000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.8909    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6784    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    4.8927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3115    2.7976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
  3 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 18 17  1  6  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 18  1  0  0  0  0
  9 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28  9  1  0  0  0  0
  8 29  1  1  0  0  0
 21 30  1  1  0  0  0
M  END
>  <Mol_ID> (262)
262

>  <Formula> (262)
C23H27FN2O4

>  <MolWeight> (262)
414.4698832

>  <Cat> (262)
S9684

>  <Name> (262)
GSK046

>  <Synonyms> (262)
iBET-BD2

>  <Target> (262)
Epigenetic Reader Domain

>  <Form> (262)
Free Base

>  <CAS> (262)
2474876-09-8

>  <URL> (262)
http://www.selleckchem.com/products/gsk046.html

$$$$

csChFnd80/07292609462D

 17 18  0  0  0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  2 11  1  0  0  0  0
  3 17  1  0  0  0  0
  4  6  1  0  0  0  0
  4  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5  7  1  0  0  0  0
  5 12  2  0  0  0  0
  5 13  1  0  0  0  0
  6  7  2  0  0  0  0
  8 11  1  0  0  0  0
  9 10  2  0  0  0  0
 10 14  1  0  0  0  0
 11 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  2  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (263)
263

>  <Formula> (263)
C14H12O3

>  <MolWeight> (263)
228.24328

>  <Cat> (263)
S3168

>  <Name> (263)
cis-Resveratrol

>  <Synonyms> (263)
cis-RESV, cRes, (Z)-Resveratrol

>  <Target> (263)
Apoptosis related,COX,DNA/RNA Synthesis,I¦ÊB/IKK,Lipoxygenase,Nrf2,Sirtuin

>  <Form> (263)
Free Base

>  <CAS> (263)
61434-67-1

>  <URL> (263)
http://www.selleckchem.com/products/cis-resveratrol.html

$$$$

csChFnd80/07292609462D

 24 26  0  0  0  0  0  0  0  0999 V2000
    3.1789    8.2621    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    8.3802    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7968    1.3951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5382    4.1918    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7472    2.0929    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9597    4.1930    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.5885    2.0928    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3299    3.4942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2268    2.4211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9499    3.2553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7451    1.1065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4683    1.9408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3658    0.8664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8548    4.8076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7566    5.8785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4765    5.0531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7475    3.4936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2802    7.1950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.3697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9018    7.4405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9596    1.3929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1721    3.4929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.3802    1.3952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 18  1  0  0  0  0
  2 24  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4 17  1  0  0  0  0
  5 17  1  0  0  0  0
  5 21  2  0  0  0  0
  6 17  2  0  0  0  0
  6 22  1  0  0  0  0
  7 24  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 14  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 13  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 15 18  1  0  0  0  0
 16 19  2  0  0  0  0
 18 20  2  0  0  0  0
 19 20  1  0  0  0  0
 21 23  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (264)
264

>  <Formula> (264)
C17H19FN4O2

>  <MolWeight> (264)
330.3567632

>  <Cat> (264)
S0864

>  <Name> (264)
ACY-775

>  <Synonyms> (264)
N/A

>  <Target> (264)
HDAC

>  <Form> (264)
Free Base

>  <CAS> (264)
1375466-18-4

>  <URL> (264)
http://www.selleckchem.com/products/acy-775.html

$$$$

csChFnd80/07292609462D

 42 45  0  0  1  0  0  0  0  0999 V2000
    1.7351   11.0870    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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    7.2632    7.6224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5649    6.0413    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4248    1.3484    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.5804    6.9077    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4378    4.9468    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.1263    3.5819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8649    2.9744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6034    3.5819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2919    4.9468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8027    5.2583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0553    1.5956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5574    7.3028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9052    5.3980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0450    0.6264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.1531    2.9926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.3460    8.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.7246    5.7661    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8460    4.3914    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6640    5.1504    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7528    1.7296    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7218    6.2464    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    4.6735    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6883    8.7336    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2276   10.4382    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8362    7.7371    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1708    6.2714    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 26  1  0  0  0  0
  2  5  1  0  0  0  0
  2  8  1  0  0  0  0
  3 19  2  0  0  0  0
  4  7  1  0  0  0  0
  4 13  2  0  0  0  0
  5 14  2  0  0  0  0
  6 19  1  0  0  0  0
  6 41  1  0  0  0  0
  6 42  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  1  1  0  0  0
  7 27  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
  9 14  1  0  0  0  0
 10 11  1  0  0  0  0
 10 15  2  0  0  0  0
 11 13  1  0  0  0  0
 11 17  2  0  0  0  0
 12 19  1  0  0  0  0
 12 28  1  0  0  0  0
 12 29  1  0  0  0  0
 13 16  1  0  0  0  0
 14 18  1  0  0  0  0
 15 20  1  0  0  0  0
 15 30  1  0  0  0  0
 16 22  2  0  0  0  0
 16 23  1  0  0  0  0
 17 21  1  0  0  0  0
 17 31  1  0  0  0  0
 18 32  1  0  0  0  0
 18 33  1  0  0  0  0
 18 34  1  0  0  0  0
 20 21  2  0  0  0  0
 20 35  1  0  0  0  0
 21 36  1  0  0  0  0
 22 24  1  0  0  0  0
 22 37  1  0  0  0  0
 23 25  2  0  0  0  0
 23 38  1  0  0  0  0
 24 26  2  0  0  0  0
 24 39  1  0  0  0  0
 25 26  1  0  0  0  0
 25 40  1  0  0  0  0
M  END
>  <Mol_ID> (265)
265

>  <Formula> (265)
C20H16ClN3O2

>  <MolWeight> (265)
365.81294

>  <Cat> (265)
S7853

>  <Name> (265)
Pelabresib (CPI-0610)

>  <Synonyms> (265)
N/A

>  <Target> (265)
Epigenetic Reader Domain,NSD

>  <Form> (265)
Free Base

>  <CAS> (265)
1380087-89-7

>  <URL> (265)
http://www.selleckchem.com/products/cpi-0610.html

$$$$

csChFnd80/07292609462D

 27 30  0  0  0  0  0  0  0  0999 V2000
    1.3076    8.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.1573    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0076    9.6124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6076    7.1876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7324    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9449    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5821    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2821    4.3876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9821    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3697    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9449    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7324    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7324    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9449    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5200    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5200    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5200    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7324    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9449    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5200    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7324    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2685    4.2484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2685    1.3514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1573    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0952    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1 17  1  0  0  0  0
  1 25  1  0  0  0  0
  2 10  1  0  0  0  0
  2 11  1  0  0  0  0
  5 21  2  0  0  0  0
  6 19  1  0  0  0  0
  6 21  1  0  0  0  0
  6 24  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8  9  1  0  0  0  0
 11 12  2  0  0  0  0
 11 14  1  0  0  0  0
 12 13  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 13 19  2  0  0  0  0
 14 18  2  0  0  0  0
 15 17  2  0  0  0  0
 16 20  1  0  0  0  0
 16 22  2  0  0  0  0
 17 18  1  0  0  0  0
 20 21  1  0  0  0  0
 20 23  2  0  0  0  0
 22 26  1  0  0  0  0
 23 27  1  0  0  0  0
 26 27  2  0  0  0  0
M  END
>  <Mol_ID> (266)
266

>  <Formula> (266)
C21H21NO4S

>  <MolWeight> (266)
383.46074

>  <Cat> (266)
S3573

>  <Name> (266)
Trotabresib

>  <Synonyms> (266)
BMS-986378,CC-90010

>  <Target> (266)
Epigenetic Reader Domain

>  <Form> (266)
Free Base

>  <CAS> (266)
1706738-98-8

>  <URL> (266)
http://www.selleckchem.com/products/cc-90010.html

$$$$

csChFnd80/07292609462D

 12 12  0  0  0  0  0  0  0  0999 V2000
    8.4870    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  2  9  2  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  2  0  0  0  0
 10 12  2  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (267)
267

>  <Formula> (267)
C10H12O2

>  <MolWeight> (267)
164.20108

>  <Cat> (267)
S3592

>  <Name> (267)
4-Phenylbutyric acid (4-PBA)

>  <Synonyms> (267)
Benzenebutyric acid

>  <Target> (267)
Autophagy,HDAC

>  <Form> (267)
Free Base

>  <CAS> (267)
1821-12-1

>  <URL> (267)
http://www.selleckchem.com/products/4-phenylbutyric-acid-4-pba-.html

$$$$

csChFnd80/07292609462D

 44 48  0  0  0  0  0  0  0  0999 V2000
    2.4122    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4122    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6247    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6247    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2040    0.0024    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.6247    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    4.8927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8329    4.8927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    6.2879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    6.9854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.8927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0453    2.7976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2536    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2536    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4660    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6784    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6784    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4660    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4660    4.1951    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.4560    5.1851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0453   13.1678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8329   12.4678    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    3.6247   13.1653    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6247   14.5605    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.0247   14.5605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2247   14.5605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6247   15.9556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207   16.6507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  1  0  0  0  0
  9 12  1  0  0  0  0
 12 13  1  0  0  0  0
 11 14  1  0  0  0  0
 11 15  1  0  0  0  0
  5 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 17  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 23  1  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 25  1  0  0  0  0
 29 32  1  0  0  0  0
 33 32  1  1  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 33  1  0  0  0  0
 36 39  1  6  0  0  0
 39 40  1  0  0  0  0
 40 41  2  0  0  0  0
 40 42  2  0  0  0  0
 40 43  1  0  0  0  0
 43 44  1  0  0  0  0
M  END
>  <Mol_ID> (268)
268

>  <Formula> (268)
C32H47FN6O4S

>  <MolWeight> (268)
630.8167832

>  <Cat> (268)
S8996

>  <Name> (268)
Revumenib

>  <Synonyms> (268)
SNDX-5613

>  <Target> (268)
MLL

>  <Form> (268)
Free Base

>  <CAS> (268)
2169919-21-3

>  <URL> (268)
http://www.selleckchem.com/products/sndx-5613.html

$$$$

csChFnd80/07292609462D

 25 26  0  0  0  0  0  0  0  0999 V2000
   10.9159    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7035    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7035    2.0928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9255    2.7983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1388    2.0978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1388    0.7034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3501    0.0040    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4915    2.7925    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.5622    0.7039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5622    2.1039    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7753    0.0035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9879    0.7036    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    7.2788    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1920    4.0057    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7916    1.5802    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0606    5.5819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6352    5.5835    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4265    4.8857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4265    3.4876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2117    5.5870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.8874    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  3  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  2  0  0  0  0
  8 15  2  0  0  0  0
 13 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 13  1  0  0  0  0
 18 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (269)
269

>  <Formula> (269)
C16H14Cl2N2O4S

>  <MolWeight> (269)
401.26436

>  <Cat> (269)
S0855

>  <Name> (269)
TC-E 5003

>  <Synonyms> (269)
NSC 30176

>  <Target> (269)
AP-1,PRMT

>  <Form> (269)
Free Base

>  <CAS> (269)
17328-16-4

>  <URL> (269)
http://www.selleckchem.com/products/tc-e-5003.html

$$$$

csChFnd80/07292609462D

 28 30  0  0  0  0  0  0  0  0999 V2000
    1.2082    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2578    2.7976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6742    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8867    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0991    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0991    4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8867    4.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3073    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.0991    6.9927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0991    8.3927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8867    9.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.8313    3.7875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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M  END
>  <Mol_ID> (270)
270

>  <Formula> (270)
C20H17FN2O4S

>  <MolWeight> (270)
400.4233832

>  <Cat> (270)
S9805

>  <Name> (270)
WM-3835

>  <Synonyms> (270)
N/A

>  <Target> (270)
Apoptosis related,Histone Acetyltransferase

>  <Form> (270)
Free Base

>  <CAS> (270)
2229025-70-9

>  <URL> (270)
http://www.selleckchem.com/products/wm-3835.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (271)
271

>  <Formula> (271)
C11H10N4O

>  <MolWeight> (271)
214.2233

>  <Cat> (271)
S9882

>  <Name> (271)
PFI-90

>  <Synonyms> (271)
N/A

>  <Target> (271)
Histone Demethylase

>  <Form> (271)
Free Base

>  <CAS> (271)
53995-62-3

>  <URL> (271)
http://www.selleckchem.com/products/pfi-90.html

$$$$

csChFnd80/07292609462D

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>  <Mol_ID> (272)
272

>  <Formula> (272)
C34H46N6O6S

>  <MolWeight> (272)
666.83064

>  <Cat> (272)
S9903

>  <Name> (272)
NRD167

>  <Synonyms> (272)
N/A

>  <Target> (272)
Sirtuin

>  <Form> (272)
Free Base

>  <CAS> (272)
2166487-23-4

>  <URL> (272)
http://www.selleckchem.com/products/nrd167.html

$$$$

csChFnd80/07292609462D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (273)
273

>  <Formula> (273)
C16H14N6O2

>  <MolWeight> (273)
322.32136

>  <Cat> (273)
S9934

>  <Name> (273)
KA2507

>  <Target> (273)
HDAC

>  <Form> (273)
free base

>  <CAS> (273)
1636894-46-6

>  <URL> (273)
http://www.selleckchem.com/products/ka2507.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (274)
274

>  <Formula> (274)
C27H24N2O4

>  <MolWeight> (274)
440.49046

>  <Cat> (274)
S2977

>  <Name> (274)
EML 425

>  <Synonyms> (274)
N/A

>  <Target> (274)
Histone Acetyltransferase

>  <Form> (274)
free base

>  <CAS> (274)
1675821-32-5

>  <URL> (274)
http://www.selleckchem.com/products/eml-425.html

$$$$

csChFnd80/07292609462D

 32 34  0  0  0  0  0  0  0  0999 V2000
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 21 22  1  0  0  0  0
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 22 28  2  0  0  0  0
 11 23  1  0  0  0  0
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  2  5  1  0  0  0  0
 29 30  1  0  0  0  0
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M  END
>  <Mol_ID> (275)
275

>  <Formula> (275)
C22H28N4O6

>  <MolWeight> (275)
444.48092

>  <Cat> (275)
S6397

>  <Name> (275)
Thalidomide-NH-C4-NH-Boc

>  <Synonyms> (275)
N/A

>  <Target> (275)
Epigenetic Reader Domain

>  <Form> (275)
free base

>  <CAS> (275)
2093388-52-2

>  <URL> (275)
http://www.selleckchem.com/products/thalidomide-nh-c4-nh-boc.html

$$$$

csChFnd80/07292609462D

 30 33  0  0  0  0  0  0  0  0999 V2000
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  8  9  2  0  0  0  0
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 28 30  2  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (276)
276

>  <Formula> (276)
C19H23N9O2

>  <MolWeight> (276)
409.44502

>  <Cat> (276)
E0338

>  <Name> (276)
AKI603

>  <Target> (276)
Aurora Kinase

>  <Form> (276)
free base

>  <CAS> (276)
1432515-73-5

>  <URL> (276)
http://www.selleckchem.com/products/aki603.html

$$$$

csChFnd80/07292609462D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 27 29  2  0  0  0  0
 28 30  2  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (277)
277

>  <Formula> (277)
C23H20N4O3

>  <MolWeight> (277)
400.4299

>  <Cat> (277)
E0342

>  <Name> (277)
Aurora kinase Inhibitor II

>  <Target> (277)
Aurora Kinase

>  <Form> (277)
free base

>  <CAS> (277)
331770-21-9

>  <URL> (277)
http://www.selleckchem.com/products/aurora-kinase-inhibitor-ii.html

$$$$

csChFnd80/07292609462D

 27 28  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (278)
278

>  <Formula> (278)
C19H21BO7

>  <MolWeight> (278)
372.17684

>  <Cat> (278)
E0394

>  <Name> (278)
YK 3-237

>  <Synonyms> (278)
N/A

>  <Target> (278)
p53,Sirtuin

>  <Form> (278)
free base

>  <CAS> (278)
1215281-19-8

>  <URL> (278)
http://www.selleckchem.com/products/yk-3-237.html

$$$$

csChFnd80/07292609462D

 22 23  0  0  0  0  0  0  0  0999 V2000
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941521-45-5

>  <URL> (280)
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free base

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934828-12-3

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>  <URL> (282)
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M  END
>  <Mol_ID> (283)
283

>  <Formula> (283)
C22H21N3O3

>  <MolWeight> (283)
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>  <Cat> (283)
E1095

>  <Name> (283)
ODM-207

>  <Target> (283)
Epigenetic Reader Domain

>  <Form> (283)
free base

>  <CAS> (283)
1801503-93-4

>  <URL> (283)
http://www.selleckchem.com/products/odm-207.html

$$$$

csChFnd80/07292609462D

 23 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (284)
284

>  <Formula> (284)
C16H13ClF3NO2

>  <MolWeight> (284)
343.7281296

>  <Cat> (284)
E1107

>  <Name> (284)
CTB

>  <Target> (284)
Histone Acetyltransferase

>  <Form> (284)
free base

>  <CAS> (284)
451491-47-7

>  <URL> (284)
http://www.selleckchem.com/products/ctb.html

$$$$

csChFnd80/07292609462D

 22 25  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
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 16 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 17  1  0  0  0  0
M  END
>  <Mol_ID> (285)
285

>  <Formula> (285)
C16H16N6

>  <MolWeight> (285)
292.33844

>  <Cat> (285)
E1132

>  <Name> (285)
CHR-6494

>  <Target> (285)
Haspin Kinase

>  <Form> (285)
free base

>  <CAS> (285)
1333377-65-3

>  <URL> (285)
http://www.selleckchem.com/products/chr-6494.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (286)
286

>  <Formula> (286)
C15H12ClN3O

>  <MolWeight> (286)
285.72828

>  <Cat> (286)
E1150

>  <Name> (286)
SIRT7 inhibitor 97491

>  <Target> (286)
Sirtuin

>  <Form> (286)
free base

>  <CAS> (286)
1807758-81-1

>  <URL> (286)
http://www.selleckchem.com/products/sirt7-inhibitor-97491.html

$$$$

csChFnd80/07292609462D

 25 26  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
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  1 24  1  0  0  0  0
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M  END
>  <Mol_ID> (287)
287

>  <Formula> (287)
C20H25N3O2

>  <MolWeight> (287)
339.4314

>  <Cat> (287)
S6738

>  <Name> (287)
TC-H 106

>  <Synonyms> (287)
Pimelic Diphenylamide 106

>  <Target> (287)
HDAC

>  <Form> (287)
free base

>  <CAS> (287)
937039-45-7

>  <URL> (287)
http://www.selleckchem.com/products/tc-h106.html

$$$$

csChFnd80/07292609462D

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  5  6  2  0  0  0  0
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  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
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 29 22  1  0  0  0  0
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M  END
>  <Mol_ID> (288)
288

>  <Formula> (288)
C30H42N8O3

>  <MolWeight> (288)
562.70628

>  <Cat> (288)
S7062

>  <Name> (288)
Pinometostat (EPZ5676)

>  <Synonyms> (288)
N/A

>  <Target> (288)
DOT1,Histone Methyltransferase

>  <Form> (288)
free base

>  <CAS> (288)
1380288-87-8

>  <URL> (288)
http://www.selleckchem.com/products/epz-5676.html

$$$$

csChFnd80/07292609462D

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 50 51  1  0  0  0  0
 51 46  1  0  0  0  0
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M  END
>  <Mol_ID> (289)
289

>  <Formula> (289)
C46H47ClN8O9S

>  <MolWeight> (289)
923.43158

>  <Cat> (289)
S8297

>  <Name> (289)
ARV-825

>  <Synonyms> (289)
N/A

>  <Target> (289)
Epigenetic Reader Domain,PROTAC

>  <Form> (289)
free base

>  <CAS> (289)
1818885-28-7

>  <URL> (289)
http://www.selleckchem.com/products/arv-825.html

$$$$

csChFnd80/07292609462D

 49 54  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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 41 36  1  0  0  0  0
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 43 44  1  0  0  0  0
 44 45  2  0  0  0  0
 45 40  1  0  0  0  0
 44 46  1  0  0  0  0
 37 47  1  0  0  0  0
 47 48  1  0  0  0  0
 47 49  2  0  0  0  0
M  END
>  <Mol_ID> (290)
290

>  <Formula> (290)
C36H41N7O6

>  <MolWeight> (290)
667.75404

>  <Cat> (290)
S8344

>  <Name> (290)
AZD-5153 6-hydroxy-2-naphthoic acid

>  <Synonyms> (290)
AZD-5153 HNT salt

>  <Target> (290)
Epigenetic Reader Domain,NSD

>  <Form> (290)
free base

>  <CAS> (290)
1869912-40-2

>  <URL> (290)
http://www.selleckchem.com/products/azd5153-6-hydroxy-2-naphthoic-acid.html

$$$$

csChFnd80/07292609462D

 28 32  0  0  0  0  0  0  0  0999 V2000
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    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6375    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8499    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6375    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6375   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1746    6.5734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8500   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4251   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0624   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4251   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6375   13.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  1  0  0  0  0
  2 12  1  0  0  0  0
  2 13  1  0  0  0  0
  3 14  1  0  0  0  0
  3 17  1  0  0  0  0
  4 17  1  0  0  0  0
  4 19  1  0  0  0  0
  4 23  1  0  0  0  0
  5 17  2  0  0  0  0
  5 22  1  0  0  0  0
  6  7  1  0  0  0  0
  6 19  2  0  0  0  0
  7 23  2  0  0  0  0
  8 24  1  0  0  0  0
  8 28  2  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 12  2  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 11 15  2  0  0  0  0
 12 16  1  0  0  0  0
 15 18  1  0  0  0  0
 16 18  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 24  2  0  0  0  0
 21 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (291)
291

>  <Formula> (291)
C20H17FN6O

>  <MolWeight> (291)
376.3869832

>  <Cat> (291)
S8983

>  <Name> (291)
MAK683

>  <Synonyms> (291)
EED inhibitor-1

>  <Target> (291)
Histone Methyltransferase

>  <Form> (291)
free base

>  <CAS> (291)
1951408-58-4

>  <URL> (291)
http://www.selleckchem.com/products/mak683.html

$$$$

csChFnd80/07292609462D

 60 66  0  0  0  0  0  0  0  0999 V2000
    0.0000   11.5526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   10.1526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3315    9.7200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1544   10.8526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5495   10.8526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.6422    9.6444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3422    8.4319    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.7422    8.4319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4422    9.6444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7422   10.8568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3422   10.8568    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1749   12.1883    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0422   13.0112    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9096   12.1883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.6374    9.6444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   20.3106    3.6032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   20.0684    2.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1009    3.6032    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.1009    6.0197    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.5315    2.3243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5719    1.3875    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   24.7843    2.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.4933    3.4569    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   25.4268    4.4937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.7914    4.2036    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   25.0657    5.8413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.7780    5.1901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.1256    4.8291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.1155    5.8190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.4678    5.4567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   30.8402    3.1144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   35.0775    2.5095    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   35.4399    3.8618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.2658    4.6243    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   32.9196    1.2662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.4261    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13  8  1  0  0  0  0
 12 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 13  1  0  0  0  0
 11 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 17  1  0  0  0  0
 20 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 29 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 34 35  1  0  0  0  0
 34 36  1  0  0  0  0
 34 37  1  0  0  0  0
 33 38  1  0  0  0  0
 33 39  2  0  0  0  0
 38 40  1  0  0  0  0
 40 41  1  0  0  0  0
 41 42  1  0  0  0  0
 42 43  1  0  0  0  0
 43 38  1  0  0  0  0
 43 44  1  6  0  0  0
 44 45  1  0  0  0  0
 44 46  2  0  0  0  0
 45 47  1  0  0  0  0
 47 48  1  0  0  0  0
 48 49  2  0  0  0  0
 49 50  1  0  0  0  0
 50 51  2  0  0  0  0
 51 52  1  0  0  0  0
 52 53  2  0  0  0  0
 53 48  1  0  0  0  0
 51 54  1  0  0  0  0
 54 55  2  0  0  0  0
 55 56  1  0  0  0  0
 56 57  2  0  0  0  0
 57 58  1  0  0  0  0
 58 54  1  0  0  0  0
 55 59  1  0  0  0  0
 32 34  1  6  0  0  0
 41 60  1  1  0  0  0
M  END
>  <Mol_ID> (292)
292

>  <Formula> (292)
C43H48N10O6S

>  <MolWeight> (292)
832.96962

>  <Cat> (292)
S9659

>  <Name> (292)
UNC6852

>  <Synonyms> (292)
N/A

>  <Target> (292)
Epigenetic Reader Domain,Histone Methyltransferase,PROTAC

>  <Form> (292)
free base

>  <CAS> (292)
2688842-08-0

>  <URL> (292)
http://www.selleckchem.com/products/unc6852.html

$$$$

csChFnd80/07292609462D

 47 50  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.6155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.6155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    3.6155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    3.6155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    3.6155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    3.6155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    2.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    3.6155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    2.9155    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    5.0155    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.7396    3.8634    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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   20.0792    5.8846    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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   20.2689    0.3377    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7042    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1190    2.3899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   22.4586    4.4112    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.5121    3.3515    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.4713    2.0276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1190    0.9900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7441    6.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9346    7.5328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9690    8.5465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2869    7.8951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.2769    6.9052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
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 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 14 16  2  0  0  0  0
 17 15  1  6  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
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 22 17  1  0  0  0  0
 23 24  1  0  0  0  0
 24 21  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
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 27 24  1  0  0  0  0
 25 28  2  0  0  0  0
 26 29  1  0  0  0  0
 22 30  1  1  0  0  0
 21 31  1  1  0  0  0
 18 32  1  1  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 33 35  1  0  0  0  0
 18 36  1  0  0  0  0
 36 19  1  0  0  0  0
 23 37  1  6  0  0  0
 24 38  1  1  0  0  0
 20 39  1  6  0  0  0
 19 40  1  1  0  0  0
 36 41  1  1  0  0  0
 36 42  1  6  0  0  0
 20 43  1  0  0  0  0
 43 44  2  0  0  0  0
 44 45  1  0  0  0  0
 45 23  1  0  0  0  0
 44 46  1  0  0  0  0
 46 47  1  0  0  0  0
M  END
>  <Mol_ID> (293)
293

>  <Formula> (293)
C36H56O8

>  <MolWeight> (293)
616.82504

>  <Cat> (293)
S7791

>  <Name> (293)
Phorbol 12-myristate 13-acetate (PMA)

>  <Synonyms> (293)
12-O-Tetradecanoylphorbol-13-acetate,TPA, Phorbol myristate acetate

>  <Target> (293)
PKC,S1P Receptor

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Free base

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16561-29-8

>  <URL> (293)
http://www.selleckchem.com/products/phorbol-12-myristate-13-acetate.html

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294

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>  <Target> (294)
PKC

>  <Form> (294)
Free base

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120685-11-2

>  <URL> (294)
http://www.selleckchem.com/products/midostaurin-pkc412.html

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295

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>  <Synonyms> (295)
N/A

>  <Target> (295)
PROTAC

>  <Form> (295)
Free base

>  <CAS> (295)
1949837-12-0

>  <URL> (295)
http://www.selleckchem.com/products/arv-771.html

$$$$

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   13.1128    2.4116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7205    2.5579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  5  8  1  0  0  0  0
  4  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13  8  2  0  0  0  0
 12 14  1  0  0  0  0
 11 15  1  0  0  0  0
 14 16  2  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 18  1  0  0  0  0
 21 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  2  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 25  1  0  0  0  0
M  END
>  <Mol_ID> (296)
297

>  <Formula> (296)
C21H18ClFN4O4

>  <MolWeight> (296)
444.8434232

>  <Cat> (296)
S0437

>  <Name> (296)
SAR-20347

>  <Synonyms> (296)
N/A

>  <Target> (296)
IFN,Interleukins,JAK

>  <Form> (296)
Free base

>  <CAS> (296)
1450881-55-6

>  <URL> (296)
http://www.selleckchem.com/products/sar-20347.html

$$$$

csChFnd80/07292609462D

 52 57  0  0  0  0  0  0  0  0999 V2000
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    0.7000   11.3024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2000   10.0899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9816    6.3000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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   10.9816    9.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    9.7692    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9816    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1941    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1941    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9816    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1941    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4065    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.8314   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6189   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4065   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0438   11.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.2562   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4687   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6811   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8936   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1060   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.3184   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.5309   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.7433   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.9557   10.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   29.1682   11.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2562    9.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.7433   12.5991    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
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 10 11  1  0  0  0  0
 11  7  2  0  0  0  0
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 12 13  2  0  0  0  0
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 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  9 18  1  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  0  0  0  0
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 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 26  1  0  0  0  0
 29 32  1  0  0  0  0
 32 33  1  0  0  0  0
 24 34  1  6  0  0  0
 34 35  2  0  0  0  0
 35 36  1  0  0  0  0
 36 37  2  0  0  0  0
 37 38  1  0  0  0  0
 38 39  2  0  0  0  0
 39 34  1  0  0  0  0
 37 40  1  0  0  0  0
 40 41  1  0  0  0  0
 41 42  1  0  0  0  0
 42 43  1  0  0  0  0
 43 44  1  0  0  0  0
 44 45  1  0  0  0  0
 45 46  1  0  0  0  0
 46 47  1  0  0  0  0
 47 48  1  0  0  0  0
 48 49  1  0  0  0  0
 49 50  1  0  0  0  0
 41 51  2  0  0  0  0
 48 52  2  0  0  0  0
 22 26  1  6  0  0  0
 20 19  1  6  0  0  0
M  END
>  <Mol_ID> (297)
298

>  <Formula> (297)
C41H43N3O7S

>  <MolWeight> (297)
721.86102

>  <Cat> (297)
S2239

>  <Name> (297)
Tubacin

>  <Synonyms> (297)
N/A

>  <Target> (297)
Antiviral,DNA/RNA Synthesis,HDAC

>  <Form> (297)
Free base

>  <CAS> (297)
537049-40-4

>  <URL> (297)
http://www.selleckchem.com/products/Tubacin.html

$$$$

csChFnd80/07292609462D

 41 42  0  0  0  0  0  0  0  0999 V2000
    1.2124    7.7547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    6.3547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    5.6547    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.6373    6.3547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.7547    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    8.4547    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3273    2.7523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6273    1.5399    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6796    2.3899    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.2920    3.0899    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6796    0.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4671    0.2899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6695    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8622    6.6344    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.6547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    6.3547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    5.6547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8722    7.6244    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    9.8547    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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    3.6373   11.9547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2020   10.2170    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.5543    9.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  6  1  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 11  1  1  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
  4 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 14  1  0  0  0  0
 14 18  1  0  0  0  0
  6 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 18  1  0  0  0  0
 24 26  2  0  0  0  0
 23 27  1  6  0  0  0
  1 28  2  0  0  0  0
  3 29  1  6  0  0  0
 15 30  1  0  0  0  0
 19 31  1  6  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 24 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 37  1  0  0  0  0
 36 38  1  0  0  0  0
 10  9  1  0  0  0  0
 39 40  2  0  0  0  0
 35 39  1  0  0  0  0
 39 10  1  0  0  0  0
  3 41  1  0  0  0  0
 41  7  1  0  0  0  0
M  END
>  <Mol_ID> (298)
299

>  <Formula> (298)
C24H36N4O6S2

>  <MolWeight> (298)
540.69584

>  <Cat> (298)
S3020

>  <Name> (298)
Romidepsin

>  <Synonyms> (298)
FK228, Depsipeptide, FR 901228, NSC 630176,

>  <Target> (298)
Apoptosis related,HDAC

>  <Form> (298)
Free base

>  <CAS> (298)
128517-07-7

>  <URL> (298)
http://www.selleckchem.com/products/Romidepsin-FK228.html

$$$$

csChFnd80/07292609462D

 23 26  0  0  0  0  0  0  0  0999 V2000
    4.8498    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5332    6.4157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1027    5.1367    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1408    6.2693    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    2.1000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.2332    7.6282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  1 10  1  0  0  0  0
  5 10  2  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 12  6  1  0  0  0  0
 13  7  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17  8  2  0  0  0  0
 14  9  2  0  0  0  0
  1 18  2  0  0  0  0
 15 19  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
 11 20  1  0  0  0  0
M  END
>  <Mol_ID> (299)
300

>  <Formula> (299)
C18H16FN3O

>  <MolWeight> (299)
309.3375432

>  <Cat> (299)
S6789

>  <Name> (299)
JAK Inhibitor I (Pyridone 6)

>  <Synonyms> (299)
CMP 6, Compound 6

>  <Target> (299)
JAK

>  <Form> (299)
Free base

>  <CAS> (299)
457081-03-7

>  <URL> (299)
http://www.selleckchem.com/products/jak-inhibitor-i.html

$$$$

csChFnd80/07292609462D

 39 42  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
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M  END
>  <Mol_ID> (300)
301

>  <Formula> (300)
C29H38Cl2N4O4

>  <MolWeight> (300)
577.54242

>  <Cat> (300)
S7042

>  <Name> (300)
AZ505

>  <Target> (300)
SMYD

>  <Form> (300)
Free base

>  <CAS> (300)
1035227-43-0

>  <URL> (300)
http://www.selleckchem.com/products/az505.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (301)
302

>  <Formula> (301)
C27H33F2N7O2

>  <MolWeight> (301)
525.5934264

>  <Cat> (301)
S8665

>  <Name> (301)
GNE-781

>  <Synonyms> (301)
N/A

>  <Target> (301)
Epigenetic Reader Domain

>  <Form> (301)
Free base

>  <CAS> (301)
1936422-33-1

>  <URL> (301)
http://www.selleckchem.com/products/gne-781.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (302)
303

>  <Formula> (302)
C25H24F4N4O5

>  <MolWeight> (302)
536.4754728

>  <Cat> (302)
S8740

>  <Name> (302)
A-485

>  <Synonyms> (302)
N/A

>  <Target> (302)
Epigenetic Reader Domain,Histone Acetyltransferase

>  <Form> (302)
Free base

>  <CAS> (302)
1889279-16-6

>  <URL> (302)
http://www.selleckchem.com/products/a-485.html

$$$$

csChFnd80/07292609462D

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 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
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 13 14  1  0  0  0  0
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 17 18  1  0  0  0  0
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 25 26  1  0  0  0  0
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 29 25  2  0  0  0  0
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 16 31  1  0  0  0  0
 16 32  2  0  0  0  0
 15 33  1  6  0  0  0
 23 34  1  0  0  0  0
M  END
>  <Mol_ID> (303)
304

>  <Formula> (303)
C24H26ClF2N5O2

>  <MolWeight> (303)
489.9453464

>  <Cat> (303)
S8782

>  <Name> (303)
LY3295668

>  <Synonyms> (303)
AK-01

>  <Target> (303)
Aurora Kinase

>  <Form> (303)
Free base

>  <CAS> (303)
1919888-06-4

>  <URL> (303)
http://www.selleckchem.com/products/ly3295668.html

$$$$

csChFnd80/07292609462D

 29 27  0  0  0  0  0  0  0  0999 V2000
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  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  3  6  1  0  0  0  0
  6  7  1  0  0  0  0
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 10 11  1  0  0  0  0
 11  6  1  0  0  0  0
  9 12  1  0  0  0  0
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 13 14  1  0  0  0  0
 12 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
  2 20  1  0  0  0  0
 20 21  1  0  0  0  0
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 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 21 26  1  0  0  0  0
M  END
>  <Mol_ID> (304)
305

>  <Formula> (304)
C20H41Cl3N4O2

>  <MolWeight> (304)
475.92414

>  <Cat> (304)
S8858

>  <Name> (304)
GSK3368715 (EPZ019997) 3HCl

>  <Target> (304)
PRMT

>  <Form> (304)
Trihydrochloride

>  <CAS> (304)
2227587-26-8

>  <URL> (304)
http://www.selleckchem.com/products/gsk3368715.html

$$$$

csChFnd80/07292609462D

 35 38  0  0  0  0  0  0  0  0999 V2000
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  4  5  2  0  0  0  0
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  2  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  2  0  0  0  0
  5 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
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 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
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 17 18  1  0  0  0  0
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 19 14  1  0  0  0  0
 17 20  1  0  0  0  0
 20 21  1  0  0  0  0
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 22 18  1  0  0  0  0
 21 23  1  0  0  0  0
 21 24  1  6  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 23  1  0  0  0  0
 27 30  1  1  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
 16 33  1  0  0  0  0
 19 34  1  0  0  0  0
 23 35  1  1  0  0  0
M  END
>  <Mol_ID> (305)
306

>  <Formula> (305)
C26H34ClN3O4

>  <MolWeight> (305)
488.01886

>  <Cat> (305)
S8926

>  <Name> (305)
Valemetostat (DS-3201)

>  <Synonyms> (305)
DS-3201b

>  <Target> (305)
EZH1/2

>  <Form> (305)
Free base

>  <CAS> (305)
1809336-39-7

>  <URL> (305)
http://www.selleckchem.com/products/valemetostat-ds-3201.html

$$$$

csChFnd80/07292609462D

 44 48  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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  6  7  1  0  0  0  0
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 31 25  1  0  0  0  0
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M  END
>  <Mol_ID> (306)
307

>  <Formula> (306)
C32H47FN6O4S

>  <MolWeight> (306)
630.8167832

>  <Cat> (306)
S8934

>  <Name> (306)
VTP50469

>  <Synonyms> (306)
N/A

>  <Target> (306)
Histone Methyltransferase,MLL

>  <Form> (306)
Free base

>  <CAS> (306)
2169916-18-9

>  <URL> (306)
http://www.selleckchem.com/products/vtp50469.html

$$$$

csChFnd80/07292609462D

 51 55  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (307)
308

>  <Formula> (307)
C34H36F3NO13

>  <MolWeight> (307)
723.6437496

>  <Cat> (307)
S9522

>  <Name> (307)
Valrubicin

>  <Synonyms> (307)
AD-32

>  <Target> (307)
PKC

>  <Form> (307)
Free base

>  <CAS> (307)
56124-62-0

>  <URL> (307)
http://www.selleckchem.com/products/valrubicin.html

$$$$

csChFnd80/07292609462D

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 31  7  1  6  0  0  0
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M  END
>  <Mol_ID> (308)
309

>  <Formula> (308)
C27H32N6O2

>  <MolWeight> (308)
472.58198

>  <Cat> (308)
S9644

>  <Name> (308)
BMS-P5

>  <Target> (308)
PAD

>  <Form> (308)
Free base

>  <CAS> (308)
1550371-22-6

>  <URL> (308)
http://www.selleckchem.com/products/bms-p5.html

$$$$

csChFnd80/07292609462D

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>  <Mol_ID> (309)
310

>  <Formula> (309)
C51H63F2N11O10

>  <MolWeight> (309)
1028.1104264

>  <Cat> (309)
S9889

>  <Name> (309)
dCBP-1

>  <Target> (309)
E3 Ligase 

>  <Form> (309)
Free base

>  <CAS> (309)
2484739-25-3

>  <URL> (309)
http://www.selleckchem.com/products/dcbp-1.html

$$$$

csChFnd80/07292609462D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (310)
311

>  <Formula> (310)
C25H22N2O2

>  <MolWeight> (310)
382.45438

>  <Cat> (310)
E0132

>  <Name> (310)
NCGC00244536

>  <Synonyms> (310)
N/A

>  <Target> (310)
Histone Demethylase

>  <Form> (310)
Free base

>  <CAS> (310)
2003260-55-5

>  <URL> (310)
http://www.selleckchem.com/products/ncgc00244536.html

$$$$

csChFnd80/07292609462D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (311)
312

>  <Formula> (311)
C20H20N4O6S

>  <MolWeight> (311)
444.461

>  <Cat> (311)
E0146

>  <Name> (311)
PF-9363 (CTx-648)

>  <Synonyms> (311)
N/A

>  <Target> (311)
Histone Acetyltransferase

>  <Form> (311)
Free base

>  <CAS> (311)
2569009-58-9

>  <URL> (311)
http://www.selleckchem.com/products/pf-9363-ctx-648.html

$$$$

csChFnd80/07292609462D

 32 34  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (312)
313

>  <Formula> (312)
C21H22ClN5O4S

>  <MolWeight> (312)
475.94848

>  <Cat> (312)
E1007

>  <Name> (312)
BRD0639

>  <Synonyms> (312)
N/A

>  <Target> (312)
PRMT

>  <Form> (312)
Free base

>  <CAS> (312)
2760881-74-9

>  <URL> (312)
http://www.selleckchem.com/products/brd0639.html

$$$$

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314

>  <Formula> (313)
C28H34N4O2

>  <MolWeight> (313)
458.59516

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E1088

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TP-064

>  <Synonyms> (313)
N/A

>  <Target> (313)
PRMT

>  <Form> (313)
Free base

>  <CAS> (313)
2080306-20-1

>  <URL> (313)
http://www.selleckchem.com/products/tp-064.html

$$$$

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>  <Mol_ID> (314)
315

>  <Formula> (314)
C27H20N4O

>  <MolWeight> (314)
416.4739

>  <Cat> (314)
E1167

>  <Name> (314)
X1 compound

>  <Target> (314)
Others

>  <Form> (314)
Free base

>  <CAS> (314)
2863686-82-0

>  <URL> (314)
http://www.selleckchem.com/products/x1-compound.html

$$$$

csChFnd80/07292609462D

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>  <Mol_ID> (315)
316

>  <Formula> (315)
C22H29FN4O2

>  <MolWeight> (315)
400.4896632

>  <Cat> (315)
E1179

>  <Name> (315)
EZM0414

>  <Target> (315)
SETD

>  <Form> (315)
Free base

>  <CAS> (315)
2411748-50-8

>  <URL> (315)
http://www.selleckchem.com/products/ezm0414.html

$$$$

csChFnd80/07292609462D

 35 37  0  0  0  0  0  0  0  0999 V2000
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A   35
.
M  END
>  <Mol_ID> (316)
317

>  <Formula> (316)
C26H26N4O4R

>  <MolWeight> (316)
458.50904

>  <Cat> (316)
E2839

>  <Name> (316)
Bisindolylmaleimide VIII (acetate)

>  <Synonyms> (316)
Ro 31-7549 acetate

>  <Target> (316)
PKC

>  <Form> (316)
Acetate

>  <CAS> (316)
138516-31-1

>  <URL> (316)
http://www.selleckchem.com/products/bisindolylmaleimide-8--acetate-.html

$$$$

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M  END
>  <Mol_ID> (317)
318

>  <Formula> (317)
C164H286N66O40

>  <MolWeight> (317)
3822.44384

>  <Cat> (317)
P1106

>  <Name> (317)
D-JNKI-1

>  <Synonyms> (317)
AM-111, XG-102, Brimapitide

>  <Target> (317)
JAK

>  <Form> (317)
Free base

>  <CAS> (317)
1445179-97-4

>  <URL> (317)
http://www.selleckchem.com/products/d-jnki-1.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (318)
319

>  <Formula> (318)
C24H21N3O3

>  <MolWeight> (318)
399.44184

>  <Cat> (318)
S2943

>  <Name> (318)
BRD9539

>  <Synonyms> (318)
N/A

>  <Target> (318)
Epigenetic Reader Domain,G9a/GLP

>  <Form> (318)
Free bC22H16Cl3N7O6ase

>  <CAS> (318)
1374601-41-8

>  <URL> (318)
http://www.selleckchem.com/products/brd9539.html

$$$$

csChFnd80/07292609462D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (319)
320

>  <Formula> (319)
C17H14F4N2O4S

>  <MolWeight> (319)
418.3626728

>  <Cat> (319)
E1086

>  <Name> (319)
KT-531

>  <Target> (319)
HDAC

>  <Form> (319)
Free base

>  <CAS> (319)
2490284-18-7

>  <URL> (319)
https://www.selleckchem.com/products/kt-531.html

$$$$

csChFnd80/07292609462D

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M  END
>  <Mol_ID> (320)
321

>  <Formula> (320)
C30H27N5O2

>  <MolWeight> (320)
489.56768

>  <Cat> (320)
S9872

>  <Name> (320)
AG-270

>  <Target> (320)
MAT2A

>  <Form> (320)
Free base

>  <CAS> (320)
2201056-66-6

>  <URL> (320)
https://www.selleckchem.com/products/ag-270.html

$$$$
2108631-19-0.MOL
csChFnd80/07292609462D

 22 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (321)
322

>  <Formula> (321)
C17H26ClN3O

>  <MolWeight> (321)
323.86084

>  <Cat> (321)
E2887

>  <Name> (321)
MS023 hydrochloride

>  <Synonyms> (321)
Compound 3

>  <Target> (321)
PRMT

>  <Form> (321)
hydrochloride

>  <CAS> (321)
2108631-19-0

>  <URL> (321)
https://www.selleckchem.com/products/ms023-hydrochloride.html

$$$$
2-Hydroxybenzoic acid 2-[(2-hydroxy-1-naphthalenyl)methylene]hydrazide
csChFnd80/07292609462D

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M  CFW   0 B_NG_STER 3
M  END
>  <Mol_ID> (322)
323

>  <Formula> (322)
C18H14N2O3

>  <MolWeight> (322)
306.31536

>  <Cat> (322)
E1335

>  <Name> (322)
SD49-7

>  <Synonyms> (322)
2-hydroxy-1-naphthalaldehyde salicyloylhydrazone

>  <Target> (322)
Histone Demethylase

>  <Form> (322)
free base

>  <CAS> (322)
54009-54-0

>  <URL> (322)
https://www.selleckchem.com/products/sd49-7.html

$$$$

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   15.9919    6.7433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3256    7.5133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9919    5.2033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.6592    6.7433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9929    7.5133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3267    6.7433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6603    7.5133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9940    6.7433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.3277    7.5133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   30.6625    7.5133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.9963    6.7433    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   37.9378    5.5729    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   39.9072   10.9508    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   44.5273    8.2833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5126    4.1728    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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    8.3682    3.1424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1389    2.7660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.9908    4.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6571    6.7433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0344    3.9124    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.6706    2.9270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3547    5.4187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3244    5.2033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9908    7.5133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3244    6.7433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8898    6.0016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6439    6.9068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2967    6.6279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8050    8.4384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4577    8.1597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2118    9.0647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.3299    7.5133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.6636    6.7433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.3299    9.0533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.9972    7.5133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.6636    9.8233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.9972    9.0533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.4620    7.0374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.4620    9.5293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   38.3672    8.2833    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   39.9072    8.2833    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   40.6772    9.6171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   40.6772    6.9497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.2172    9.6171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   42.2172    6.9497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.9873    8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 36  2  0  0  0  0
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  3  4  1  0  0  0  0
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  4  7  1  0  0  0  0
  6 47  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  1  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  8 12  1  0  0  0  0
 13 43  2  0  0  0  0
 14 15  1  0  0  0  0
 14 46  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 53  1  0  0  0  0
 29 52  1  0  0  0  0
 30 59  2  0  0  0  0
 31 60  2  0  0  0  0
 32 63  2  0  0  0  0
 33 67  2  0  0  0  0
 34 35  1  0  0  0  0
 34 36  1  0  0  0  0
 34 37  1  1  0  0  0
 34 38  1  0  0  0  0
 35 39  1  0  0  0  0
 35 40  2  0  0  0  0
 36 41  1  0  0  0  0
 37 42  1  0  0  0  0
 38 43  1  0  0  0  0
 39 42  1  0  0  0  0
 39 44  2  0  0  0  0
 40 45  1  0  0  0  0
 41 43  1  0  0  0  0
 44 46  1  0  0  0  0
 45 46  2  0  0  0  0
 47 48  2  0  0  0  0
 47 49  1  0  0  0  0
 48 50  1  0  0  0  0
 49 51  2  0  0  0  0
 50 52  2  0  0  0  0
 51 52  1  0  0  0  0
 53 54  1  0  0  0  0
 53 55  2  0  0  0  0
 54 56  2  0  0  0  0
 55 57  1  0  0  0  0
 56 58  1  0  0  0  0
 56 59  1  0  0  0  0
 57 58  2  0  0  0  0
 58 60  1  0  0  0  0
 59 61  1  0  0  0  0
 60 61  1  0  0  0  0
 61 62  1  0  0  0  0
 62 63  1  0  0  0  0
 62 64  1  0  0  0  0
 63 65  1  0  0  0  0
 64 66  1  0  0  0  0
 65 67  1  0  0  0  0
 66 67  1  0  0  0  0
M  END
>  <Mol_ID> (323)
324

>  <Formula> (323)
C48H52F4N6O9

>  <MolWeight> (323)
932.9548928

>  <Cat> (323)
E1215

>  <Name> (323)
JQAD1

>  <Target> (323)
Histone Acetyltransferase

>  <Form> (323)
free base

>  <CAS> (323)
2417097-18-6

>  <URL> (323)
https://www.selleckchem.com/products/jqad1.html

$$$$
N-[4-Chloro-3-(trifluoromethyl)phenyl]-2-propoxybenzamide
csChFnd80/07292609462D

 24 25  0  0  0  0  0  0  0  0999 V2000
    7.7000    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1600    4.0011    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4700    5.3347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7800    4.0011    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3200    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0900    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6300    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5400    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5400    8.2084    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.6684    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.5400    5.1284    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    9.3358    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    8.4700    2.6674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0100    2.6674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7000    1.3336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7800    1.3336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4700    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0100    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3900    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8500    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1600    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3900    8.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8500    8.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1 13  1  0  0  0  0
  2 19  1  0  0  0  0
  4  5  1  0  0  0  0
  4 14  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  8 22  1  0  0  0  0
 12 24  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  2  0  0  0  0
 17 18  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (324)
325

>  <Formula> (324)
C17H15ClF3NO2

>  <MolWeight> (324)
357.7547096

>  <Cat> (324)
S2966

>  <Name> (324)
TTK21

>  <Target> (324)
Epigenetic Reader Domain

>  <Form> (324)
Free base

>  <CAS> (324)
709676-56-2

>  <URL> (324)
https://www.selleckchem.com/products/ttk21.html

$$$$
CTPB (enzyme activator)
csChFnd80/07292609462D

 38 39  0  0  0  0  0  0  0  0999 V2000
    7.7000    9.3358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1600    9.3358    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4700    8.0020    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7800    9.3358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3200    9.3358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0900    8.0020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6300    8.0020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4000    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9400    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7100    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2500    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0200    4.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5600    4.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3300    2.6673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.8500   13.3367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5400    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0800    4.0011    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    8.4700   10.6694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0100   10.6694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7000   12.0031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7800   12.0031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4700   13.3367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0100   13.3367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3900    8.0020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8500    8.0020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1600    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3900    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8500    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1 27  1  0  0  0  0
  2 33  1  0  0  0  0
  4  5  1  0  0  0  0
  4 28  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 19 20  1  0  0  0  0
 19 29  1  0  0  0  0
 20 21  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 22 25  1  0  0  0  0
 22 36  1  0  0  0  0
 26 38  1  0  0  0  0
 27 28  2  0  0  0  0
 27 29  1  0  0  0  0
 28 30  1  0  0  0  0
 29 31  2  0  0  0  0
 30 32  2  0  0  0  0
 31 32  1  0  0  0  0
 33 34  2  0  0  0  0
 33 35  1  0  0  0  0
 34 36  1  0  0  0  0
 35 37  2  0  0  0  0
 36 38  2  0  0  0  0
 37 38  1  0  0  0  0
M  END
>  <Mol_ID> (325)
326

>  <Formula> (325)
C31H43ClF3NO2

>  <MolWeight> (325)
554.1268296

>  <Cat> (325)
E1654

>  <Name> (325)
CTPB

>  <Target> (325)
Histone Acetyltransferase

>  <Form> (325)
Free base

>  <CAS> (325)
586976-24-1

>  <URL> (325)
https://www.selleckchem.com/products/ctpb.html

$$$$
6-(3,5-Dimethyl-4-isoxazolyl)-N-methyl-1-(phenylmethyl)-1H-imidazo[4,5-b]pyri...
csChFnd80/07292609462D

 25 28  0  0  0  0  0  0  0  0999 V2000
    8.3315    4.5255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6942    1.4647    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.1701    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1437    2.8888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7710    6.9174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0299    3.0307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5615    3.1917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7097    1.5245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8854    4.0612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1878    1.7849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0434    0.7545    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2450    1.0484    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4208    3.5853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1007    2.0790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8715    4.5255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6415    3.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6415    5.8591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1815    3.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1815    5.8591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9515    4.5255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2763    4.6159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7700    4.2956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4374    6.1474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.6294    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0304    6.7737    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2 10  1  0  0  0  0
  4 22  1  0  0  0  0
  5 23  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  8 12  2  0  0  0  0
  9 13  1  0  0  0  0
 10 11  2  0  0  0  0
 12 14  1  0  0  0  0
 13 14  2  0  0  0  0
 13 21  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 19 20  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
 23 25  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (326)
327

>  <Formula> (326)
C19H19N5O

>  <MolWeight> (326)
333.38706

>  <Cat> (326)
E1517

>  <Name> (326)
ZEN-3694

>  <Target> (326)
Epigenetic Reader Domain

>  <Form> (326)
Free base

>  <CAS> (326)
1643947-30-1

>  <URL> (326)
https://www.selleckchem.com/products/zen-3694.html

$$$$
(2R)-7-Chloro-N-[[1,2-dihydro-6-methyl-4-(methylthio)-2-oxo-3-pyridinyl]methy...
csChFnd80/07292609462D

 39 43  0  0  0  0  0  0  0  0999 V2000
   10.6694    0.7700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6694    6.9300    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   15.5173    2.8196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0021    2.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6684    3.0800    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0021    0.7700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3347    2.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    0.7700    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3336    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3347    5.3900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.8501    5.1715    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.5732    6.5311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.3900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0031    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0031    4.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4678    2.6041    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6694    2.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4678    5.0959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6694    5.3900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3730    3.8500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.3358    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3358    4.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5173    4.8804    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   16.3334    3.5745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2404    6.2402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8725    3.6282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7795    6.2940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5955    4.9879    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.0011    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    2.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0011    4.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3336    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    5.3900    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3336    4.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1346    5.0417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.2608    3.9914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1849    6.1680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3111    5.1177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3038    5.8286    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 17  1  0  0  0  0
  2 19  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4 21  1  0  0  0  0
  5  7  1  0  0  0  0
  7 29  1  0  0  0  0
  8  9  1  0  0  0  0
  8 30  1  0  0  0  0
 10 31  2  0  0  0  0
 11 12  1  0  0  0  0
 11 38  1  0  0  0  0
 13 34  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 15 18  1  0  0  0  0
 15 19  2  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 20  1  0  0  0  0
 19 22  1  0  0  0  0
 20  3  1  1  0  0  0
 20 23  1  0  0  0  0
 21 22  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 23 39  1  6  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 26  1  6  0  0  0
 28 35  1  0  0  0  0
 29 30  2  0  0  0  0
 29 31  1  0  0  0  0
 30 32  1  0  0  0  0
 31 33  1  0  0  0  0
 32 34  2  0  0  0  0
 33 34  1  0  0  0  0
 35 36  1  0  0  0  0
 35 37  1  0  0  0  0
 36 38  1  0  0  0  0
 37 38  1  0  0  0  0
M  END
>  <Mol_ID> (327)
328

>  <Formula> (327)
C28H36ClN3O5S

>  <MolWeight> (327)
562.12054

>  <Cat> (327)
E1497

>  <Name> (327)
Tulmimetostat

>  <Synonyms> (327)
CPI-0209

>  <Target> (327)
EZH1/2

>  <Form> (327)
Free base

>  <CAS> (327)
2567686-02-4

>  <URL> (327)
https://www.selleckchem.com/products/tulmimetostat.html

$$$$
Benzamide, N-hydroxy-4-[[5-(2-thienyl)-1H-tetrazol-1-yl]methyl]-
csChFnd80/07292609462D

 21 23  0  0  0  0  0  0  0  0999 V2000
    5.4902    3.7711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6503    3.7711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4203    5.1047    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.4203    2.4374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9603    5.1047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1885    2.2763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7202    2.4374    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8683    0.7700    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3465    1.0304    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2020    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1580    3.4209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4782    4.9271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6265    3.2598    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.1445    5.6972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0302    3.7711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8002    2.4374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8002    5.1047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3402    2.4374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3402    5.1047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1102    3.7711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  2 21  1  0  0  0  0
  3  5  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  2  0  0  0  0
  6 11  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 10  2  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 15  2  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (328)
329

>  <Formula> (328)
C13H11N5O2S

>  <MolWeight> (328)
301.32374

>  <Cat> (328)
E1469

>  <Name> (328)
ITF3756

>  <Target> (328)
HDAC6?selective inhibitors

>  <Form> (328)
Free base

>  <CAS> (328)
2247608-27-9

>  <URL> (328)
https://www.selleckchem.com/products/itf3756.html

$$$$
Methyl 2-[[(5-bromo-4-fluoro-2-methylphenyl)amino]sulfonyl]-5-[[(3,5-dichloro...
csChFnd80/07292609462D

 35 37  0  0  0  0  0  0  0  0999 V2000
    6.1601    2.6673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9302    1.3337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    2.6673    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1601    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0801    5.3348    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    3.7948    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    6.8749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7802    5.3348    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.5503    6.6685    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   10.2166    7.4385    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    8.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3101    9.3360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7700    9.3360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3203    8.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8603    8.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5503    9.3360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6303    9.3360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3203   10.6697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8603   10.6697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1 18  1  0  0  0  0
  2  4  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  2  0  0  0  0
  5 19  1  0  0  0  0
  6 24  1  0  0  0  0
  9 10  1  0  0  0  0
  9 22  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  2  0  0  0  0
 10 30  1  0  0  0  0
 13 25  1  0  0  0  0
 14 28  1  0  0  0  0
 15 29  1  0  0  0  0
 16 33  1  0  0  0  0
 17 34  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 22 23  1  0  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
 26 28  2  0  0  0  0
 27 29  2  0  0  0  0
 28 29  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
 31 33  1  0  0  0  0
 32 34  2  0  0  0  0
 33 35  2  0  0  0  0
 34 35  1  0  0  0  0
M  END
>  <Mol_ID> (329)
330

>  <Formula> (329)
C21H16BrCl2FN2O6S2

>  <MolWeight> (329)
626.2999432

>  <Cat> (329)
E1267

>  <Name> (329)
MDL-800

>  <Target> (329)
Sirtuin

>  <Form> (329)
free base

>  <CAS> (329)
2275619-53-7

>  <URL> (329)
https://www.selleckchem.com/products/mdl-800.html

$$$$

csChFnd80/07292609462D

 35 39  0  0  0  0  0  0  0  0999 V2000
   -7.5000  -12.9904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0000  -12.9904    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2500  -11.6913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7500  -11.6913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0000  -12.9904    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000  -12.9904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500  -14.2894    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3107  -18.7246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5000  -12.9904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5000   -2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000   -2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500  -11.6913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7500  -14.2894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2500  -14.2894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 34  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 14  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 10  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 33  2  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  6  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 32  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 26  1  0  0  0  0
 32 23  1  0  0  0  0
 33  6  1  0  0  0  0
 34 35  1  0  0  0  0
 35  2  1  0  0  0  0
M  END
>  <Mol_ID> (330)
331

>  <Formula> (330)
C27H38N6O2

>  <MolWeight> (330)
478.62962

>  <Cat> (330)
E1429

>  <Name> (330)
T1-44

>  <Target> (330)
PRMT

>  <Form> (330)
free base

>  <URL> (330)
https://www.selleckchem.com/products/t1-44.html

$$$$
