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404950-80-7

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AR-42.cdx
csChFnd80/10301815042D

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HDAC 

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vorinostat.cdx
csChFnd80/10301815042D

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SAHA, MK0683, suberoylanilide hydroxamic acid

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HDAC

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http://www.selleckchem.com/products/Vorinostat-(SAHA).html

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149647-78-9

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untitled.cdx
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Aurora Kinase

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http://www.selleckchem.com/products/VX-680(MK-0457).html

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639089-54-6

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HDAC 

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Enzastaurin (LY317615)

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>  <Synonyms> (7)
N/A 

>  <Target> (7)
PKC 

>  <Form> (7)
Free Base

>  <URL> (7)
http://www.selleckchem.com/products/Enzastaurin.html

>  <CAS Number> (7)
170364-57-5

$$$$
AZD2281.cdx
csChFnd80/10301815042D

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KU-0059436 

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PARP 

>  <Form> (8)
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>  <URL> (8)
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763113-22-0

$$$$
untitled.cdx
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HDAC 

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414864-00-9

$$$$
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Sirtuin

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1001645-58-4

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3544-24-9

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Alisertib

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Aurora Kinase

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>  <URL> (20)
http://www.selleckchem.com/products/MLN8237.html

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1028486-01-2

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AG-490 (Tyrphostin B42)

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N/A

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JAK, EGFR

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Free Base

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http://www.selleckchem.com/products/AG-490.html

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133550-30-8 

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untitled.cdx
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Barasertib (AZD1152-HQPA)

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S1147

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AZD1152 

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Aurora Kinase

>  <Form> (23)
Free Base

>  <URL> (23)
http://www.selleckchem.com/products/AZD1152-HQPA.html

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722544-51-6

$$$$
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csChFnd80/10301815042D

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>  <Mol_ID> (24)
24

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C9H12ClF2N3O4
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Gemcitabine HCl (Gemzar)

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S1149

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Gemzar

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DNA/RNA Synthesis

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Hydrochloride

>  <URL> (24)
http://www.selleckchem.com/products/Gemcitabine-Hydrochloride(Gemzar).html

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122111-03-9

$$$$
cyc116.cdx
csChFnd80/10301815042D

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C18H20N6OS

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C18H20N6OS
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CYC116

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S1171

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N/A

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Aurora Kinase, VEGFR

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Free Base

>  <URL> (25)
http://www.selleckchem.com/products/CYC116.html

>  <CAS Number> (25)
693228-63-6

$$$$
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Flt, Aurora Kinase, VEGFR

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Tartaric Acid 

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http://www.selleckchem.com/products/ENMD-2076.html

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934353-76-1

$$$$
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csChFnd80/10301815042D

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   13.2989    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.2989    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0453    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6289    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    2.0976    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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 10  2  1  0  0  0  0
  6 11  1  0  0  0  0
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 17 12  1  0  0  0  0
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 18 19  3  0  0  0  0
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  8 22  1  0  0  0  0
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 29 30  1  0  0  0  0
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 30 32  1  0  0  0  0
M  END
>  <Mol_ID> (27)
27

>  <Formula> (27)
C24H26N4O4

>  <MolWeight> (27)
434.48764

>  <Formula_> (27)
C24H26N4O4
C24H26N4O4

>  <MolWeight_> (27)
434.48764

>  <Item Name> (27)
CUDC-101

>  <Catalog Number> (27)
S1194

>  <Synonyms> (27)
N/A

>  <Target> (27)
HDAC, EGFR, HER2

>  <Form> (27)
Free Base

>  <URL> (27)
http://www.selleckchem.com/products/CUDC-101.html

>  <CAS Number> (27)
1012054-59-9

$$$$
decitabine (2¡ä-deoxy-5-azacytidine).cdx
csChFnd80/10301815042D

 16 17  0  0  0  0  0  0  0  0999 V2000
    4.2124    3.2474    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.8601    3.6097    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0976    2.4356    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.9786    1.3476    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2856    1.8493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6976    2.4356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.2274    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6175    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.6036    3.6237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.4726    5.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1656    6.3892    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7751    6.0081    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
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  3  6  1  1  0  0  0
  6  7  1  0  0  0  0
  4  8  1  6  0  0  0
  1  9  1  1  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
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 14  9  1  0  0  0  0
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 12 16  1  0  0  0  0
M  END
>  <Mol_ID> (28)
28

>  <Formula> (28)
C8H12N4O4

>  <MolWeight> (28)
228.20528

>  <Formula_> (28)
C8H12N4O4
C8H12N4O4

>  <MolWeight_> (28)
228.20528

>  <Item Name> (28)
Decitabine

>  <Catalog Number> (28)
S1200

>  <Synonyms> (28)
Dacogen

>  <Target> (28)
DNA/RNA Synthesis

>  <Form> (28)
Free Base

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

>  <CAS Number> (28)
2353-33-5

$$$$
Carboplatin.cdx
csChFnd80/10301815042D

 13 10  0  0  0  0  0  0  0  0999 V2000
    3.2875    2.4207    0.0000 Pt  0  2  0  0  0  0  0  0  0  0  0  0
    3.9875    1.2082    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    5.3875    1.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0875    2.4207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3875    3.6331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9875    3.6331    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.0851    4.8413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0851    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0774    1.4307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0674    2.4207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0774    3.4106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7617    2.4207    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3617    2.4207    0.0000 N   0  0  0  0  0  0  0  0  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
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  3  8  2  0  0  0  0
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  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11  4  1  0  0  0  0
M  END
>  <Mol_ID> (29)
29

>  <Formula> (29)
C6H12N2O4Pt

>  <MolWeight> (29)
371.24848

>  <Formula_> (29)
C6H12N2O4Pt
C6H12N2O4Pt

>  <MolWeight_> (29)
371.24848

>  <Item Name> (29)
Carboplatin

>  <Catalog Number> (29)
S1215

>  <Synonyms> (29)
Paraplatin

>  <Target> (29)
DNA/RNA Synthesis

>  <Form> (29)
Free Base

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

>  <CAS Number> (29)
41575-94-4

$$$$
2-Methoxyestradiol.cdx
csChFnd80/10301815042D

 25 28  0  0  0  0  0  0  0  0999 V2000
    2.4165    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8413    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6289    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0538    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    2.1000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.0538    2.8000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.4786    2.8000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.4786    4.2000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2662    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0538    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8101    2.3674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6330    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8101    4.6326    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    0.0000    2.1000    0.0000 C   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  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
  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 10  1  0  0  0  0
 11 15  1  0  0  0  0
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 17 12  1  0  0  0  0
  1 18  1  0  0  0  0
 18 19  1  0  0  0  0
  2 20  1  0  0  0  0
 10 21  1  6  0  0  0
  9 22  1  1  0  0  0
 12 23  1  1  0  0  0
 17 24  1  1  0  0  0
 11 25  1  6  0  0  0
M  END
>  <Mol_ID> (30)
30

>  <Formula> (30)
C19H26O3

>  <MolWeight> (30)
302.40794

>  <Formula_> (30)
C19H26O3
C19H26O3

>  <MolWeight_> (30)
302.40794

>  <Item Name> (30)
2-Methoxyestradiol

>  <Catalog Number> (30)
S1233

>  <Synonyms> (30)
2-ME2

>  <Target> (30)
HIF

>  <Form> (30)
Free Base

>  <URL> (30)
http://www.selleckchem.com/products/2-Methoxyestradiol(2ME2).html

>  <CAS Number> (30)
362-07-2

$$$$
JNJ-7706621.cdx
csChFnd80/10301815042D

 27 29  0  0  0  0  0  0  0  0999 V2000
    2.0927    4.8115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7927    3.5990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1927    3.5990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8927    4.8115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1927    6.0239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7927    6.0239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6976    4.8115    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.6032    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9257    3.7324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.0892    0.1325    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
  7  9  2  0  0  0  0
  7 10  2  0  0  0  0
  4 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
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 16 12  2  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
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 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
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 20 26  1  0  0  0  0
 18 27  2  0  0  0  0
M  END
>  <Mol_ID> (31)
31

>  <Formula> (31)
C15H12F2N6O3S

>  <MolWeight> (31)
394.3559864

>  <Formula_> (31)
C15H12F2N6O3S
C15H12F2N6O3S

>  <MolWeight_> (31)
394.3559864

>  <Item Name> (31)
JNJ-7706621

>  <Catalog Number> (31)
S1249

>  <Synonyms> (31)
N/A 

>  <Target> (31)
CDK, Aurora Kinase

>  <Form> (31)
Free Base

>  <URL> (31)
http://www.selleckchem.com/products/JNJ-7706621.html

>  <CAS Number> (31)
443797-96-4

$$$$
Nicotinamide.cdx
csChFnd80/10301815042D

  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
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    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
  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
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  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
M  END
>  <Mol_ID> (32)
32

>  <Formula> (32)
C6H6N2O

>  <MolWeight> (32)
122.12464

>  <Formula_> (32)
C6H6N2O
C6H6N2O

>  <MolWeight_> (32)
122.12464

>  <Item Name> (32)
Nicotinamide (Vitamin B3)

>  <Catalog Number> (32)
S1899

>  <Synonyms> (32)
Niacinamide

>  <Target> (32)
Sirtuin

>  <Form> (32)
Free Base

>  <URL> (32)
http://www.selleckchem.com/products/Nicotinamide(Niacinamide).html

>  <CAS Number> (32)
98-92-0

$$$$
Ellagic acid.cdx
csChFnd80/10301815042D

 22 25  0  0  0  0  0  0  0  0999 V2000
    2.4207    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    2.0951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6331    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2082    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.2927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.4976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8455    7.6903    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  1  0  0  0  0
  4  5  1  0  0  0  0
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 10  5  2  0  0  0  0
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 13  6  2  0  0  0  0
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 16  1  2  0  0  0  0
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  9 20  1  0  0  0  0
  8 21  1  0  0  0  0
 12 22  2  0  0  0  0
M  END
>  <Mol_ID> (33)
33

>  <Formula> (33)
C14H6O8

>  <MolWeight> (33)
302.19264

>  <Formula_> (33)
C14H6O8
C14H6O8

>  <MolWeight_> (33)
302.19264

>  <Item Name> (33)
Ellagic acid

>  <Catalog Number> (33)
S1327

>  <Synonyms> (33)
N/A

>  <Target> (33)
Topoisomerases

>  <Form> (33)
Free Base

>  <URL> (33)
http://www.selleckchem.com/products/Ellagic-acid.html

>  <CAS Number> (33)
476-66-4

$$$$
Mizoribine.cdx
csChFnd80/10301815042D

 18 19  0  0  0  0  0  0  0  0999 V2000
    4.1414    3.2474    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.7891    3.6097    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0266    2.4356    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.9077    1.3476    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2147    1.8493    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.2256    4.1254    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6334    2.3626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.1195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5466    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3847    1.0895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5779    3.7630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3404    4.9372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 14  6  1  0  0  0  0
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 16 17  1  0  0  0  0
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M  END
>  <Mol_ID> (34)
34

>  <Formula> (34)
C9H13N3O6

>  <MolWeight> (34)
259.21602

>  <Formula_> (34)
C9H13N3O6
C9H13N3O6

>  <MolWeight_> (34)
259.21602

>  <Item Name> (34)
Mizoribine (Bredinin)

>  <Catalog Number> (34)
S1384

>  <Synonyms> (34)
HE 69

>  <Target> (34)
DNA/RNA Synthesis

>  <Form> (34)
Free Base

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

>  <CAS Number> (34)
50924-49-7

$$$$
resveratrol.cdx
csChFnd80/10301815042D

 17 18  0  0  0  0  0  0  0  0999 V2000
    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
    0.0000    3.8837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3998    2.4368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    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
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 14 16  1  0  0  0  0
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M  END
>  <Mol_ID> (35)
35

>  <Formula> (35)
C14H12O3

>  <MolWeight> (35)
228.24328

>  <Formula_> (35)
C14H12O3
C14H12O3

>  <MolWeight_> (35)
228.24328

>  <Item Name> (35)
Resveratrol

>  <Catalog Number> (35)
S1396

>  <Synonyms> (35)
N/A

>  <Target> (35)
Sirtuin

>  <Form> (35)
Free Base

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

>  <CAS Number> (35)
501-36-0

$$$$
Droxinostat.cdx
csChFnd80/10301815042D

 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
    2.4291    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6458    0.7024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6458    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4291    2.8098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0024    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    0.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0706    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (36)
36

>  <Formula> (36)
C11H14ClNO3

>  <MolWeight> (36)
243.68676

>  <Formula_> (36)
C11H14ClNO3
C11H14ClNO3

>  <MolWeight_> (36)
243.68676

>  <Item Name> (36)
Droxinostat

>  <Catalog Number> (36)
S1422

>  <Synonyms> (36)
N/A

>  <Target> (36)
HDAC 

>  <Form> (36)
Free Base

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

>  <CAS Number> (36)
99873-43-5

$$$$
Aurora A Inhibitor I.cdx
csChFnd80/10301815042D

 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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   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
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M  END
>  <Mol_ID> (37)
37

>  <Formula> (37)
C31H31ClFN7O2

>  <MolWeight> (37)
588.0749432

>  <Formula_> (37)
C31H31ClFN7O2
C31H31ClFN7O2

>  <MolWeight_> (37)
588.0749432

>  <Item Name> (37)
Aurora A Inhibitor I

>  <Catalog Number> (37)
S1451

>  <Synonyms> (37)
N/A

>  <Target> (37)
Aurora Kinase

>  <Form> (37)
Free Base

>  <URL> (37)
http://www.selleckchem.com/products/Aurora-A-Inhibitor-I.html

>  <CAS Number> (37)
1158838-45-9

$$$$
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>  <Target> (38)
Aurora Kinase

>  <Form> (38)
Free Base

>  <URL> (38)
http://www.selleckchem.com/products/PHA-680632.html

>  <CAS Number> (38)
398493-79-3

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N/A 

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HIF

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Free Base

>  <URL> (39)
http://www.selleckchem.com/products/fg-4592.html

>  <CAS Number> (39)
808118-40-3

$$$$
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MC1568

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N/A

>  <Target> (40)
HDAC 

>  <Form> (40)
Free Base

>  <URL> (40)
http://www.selleckchem.com/products/MC1568.html

>  <CAS Number> (40)
852475-26-4

$$$$
CHIBROXIN (norfloxacin).cdx
csChFnd80/10301815042D

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>  <Item Name> (41)
Norfloxacin (Norxacin)

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>  <Synonyms> (41)
Chibroxin, MK-366, Baccidal, Sebercim, Zoroxin 

>  <Target> (41)
Others

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Free Base

>  <URL> (41)
http://www.selleckchem.com/products/Norfloxacin(Norxacin).html

>  <CAS Number> (41)
70458-96-7

$$$$
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934162-61-5

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Hesperadin .cdx
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Aurora Kinase

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EX527.cdx
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49843-98-3

$$$$
Fasudil HCl.cdx
csChFnd80/10301815042D

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ROCK

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105628-07-7

$$$$

csChFnd80/10301815042D

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   10.0745  -13.2902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0745  -11.8902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.2829  -11.1926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.4292   -9.8003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8861  -10.8675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4153  -12.1636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8024  -12.3534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6603  -11.2470    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.1311   -9.9509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7440   -9.7611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8926   -8.3950    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.4926   -8.3950    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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  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  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
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  9 17  1  0  0  0  0
 13 18  1  0  0  0  0
 15 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  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 21  1  0  0  0  0
 17 27  2  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
 30 17  1  0  0  0  0
 28 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 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 31  1  0  0  0  0
M  END
>  <Mol_ID> (47)
47

>  <Formula> (47)
C27H30Cl2F2N6O

>  <MolWeight> (47)
563.4695064

>  <Formula_> (47)
C27H30Cl2F2N6O
C27H30Cl2F2N6O

>  <MolWeight_> (47)
563.4695064

>  <Item Name> (47)
NVP-BSK805 2HCl

>  <Catalog Number> (47)
S2686 

>  <Synonyms> (47)
N/A

>  <Target> (47)
JAK

>  <Form> (47)
HCl

>  <URL> (47)
http://www.selleckchem.com/products/nvp-bsk805.html

>  <CAS Number> (47)
1092499-93-8 (free base)

$$$$
DEPOCYT (cytarabine).cdx
csChFnd80/10301815042D

 17 18  0  0  0  0  0  0  0  0999 V2000
    5.6315    5.0555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6315    3.6555    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8440    2.9555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0564    3.6555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0564    5.0555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8440    5.7555    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4233    5.7531    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2646    5.7531    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4233    2.9579    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.1443    3.5274    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2075    2.4870    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.9075    1.2745    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2769    1.5656    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.8200    2.6328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3137    0.6321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3401    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.5041    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  1  1  0  0  0  0
  1  7  2  0  0  0  0
  5  8  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  9  1  0  0  0  0
  9  2  1  1  0  0  0
 11 14  1  1  0  0  0
 13 15  1  1  0  0  0
 12 16  1  6  0  0  0
 14 17  1  0  0  0  0
M  END
>  <Mol_ID> (48)
48

>  <Formula> (48)
C9H13N3O5

>  <MolWeight> (48)
243.21662

>  <Formula_> (48)
C9H13N3O5
C9H13N3O5

>  <MolWeight_> (48)
243.21662

>  <Item Name> (48)
Cytarabine

>  <Catalog Number> (48)
S1648

>  <Synonyms> (48)
N/A 

>  <Target> (48)
Others

>  <Form> (48)
Free Base

>  <URL> (48)
http://www.selleckchem.com/products/Cytarabine(Cytosar-U).html

>  <CAS Number> (48)
147-94-4

$$$$
DIVALPROEX (divalproex sodium).cdx
csChFnd80/10301815042D

 21 18  0  0  0  0  0  0  0  0999 V2000
    2.7976   14.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1976   14.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000   13.2768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000   15.6932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000   15.6932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000   13.2768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0024   16.9014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   12.0643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8976   13.2726    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.5107    0.0000    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    4.8951   15.6932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2663   14.4121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6663   14.4121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5688   13.2038    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5688   15.6203    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3639   15.6203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3639   13.2038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7639   15.6203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4639   16.8327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7639   13.2038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4615   11.9956    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  1  0  0  0  0
  4  5  1  0  0  0  0
  3  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  2  9  1  0  0  0  0
  2 11  2  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  1  0  0  0  0
 13 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 17 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (49)
49

>  <Formula> (49)
C16H31NaO4

>  <MolWeight> (49)
310.40471

>  <Formula_> (49)
C16H31NaO4
C16H31NaO4

>  <MolWeight_> (49)
310.40471

>  <Item Name> (49)
Divalproex sodium

>  <Catalog Number> (49)
S1703

>  <Synonyms> (49)
Depakote, Epival

>  <Target> (49)
HDAC

>  <Form> (49)
Sodium Salt

>  <URL> (49)
http://www.selleckchem.com/products/Divalproex-sodium.html

>  <CAS Number> (49)
76584-70-8

$$$$
THIOGUANINE (thioguanine).cdx
csChFnd80/10301815042D

 11 12  0  0  0  0  0  0  0  0999 V2000
    1.2082    2.1000    0.0000 N   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 N   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
    4.9646    0.2674    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7875    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9646    2.5326    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0024    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.1951    0.0000 S   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  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  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
  2 10  1  0  0  0  0
  6 11  2  0  0  0  0
M  END
>  <Mol_ID> (50)
50

>  <Formula> (50)
C5H5N5S

>  <MolWeight> (50)
167.1917

>  <Formula_> (50)
C5H5N5S
C5H5N5S

>  <MolWeight_> (50)
167.1917

>  <Item Name> (50)
Thioguanine

>  <Catalog Number> (50)
S1774

>  <Synonyms> (50)
6-Thioguanine

>  <Target> (50)
Others

>  <Form> (50)
Free Base

>  <URL> (50)
http://www.selleckchem.com/products/Thioguanine.html

>  <CAS Number> (50)
154-42-7

$$$$
VIDAZA (azacitidine).cdx
csChFnd80/10301815042D

 17 18  0  0  0  0  0  0  0  0999 V2000
    3.7390    7.6619    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.3867    7.2996    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.3134    5.9015    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6204    5.3998    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.5015    6.4878    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2390    8.9644    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8947    6.4148    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3025    8.1776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9815    4.0522    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.6776    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9916    3.0622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3539    1.7099    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7062    1.3476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6962    2.3376    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3338    3.6898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6440    3.4233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0673    0.0000    0.0000 N   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  1  1  0  0  0  0
  1  6  1  1  0  0  0
  5  7  1  1  0  0  0
  2  8  1  6  0  0  0
  4  9  1  6  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 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  9  1  0  0  0  0
 11 16  2  0  0  0  0
 13 17  1  0  0  0  0
M  END
>  <Mol_ID> (51)
51

>  <Formula> (51)
C8H12N4O5

>  <MolWeight> (51)
244.20468

>  <Formula_> (51)
C8H12N4O5
C8H12N4O5

>  <MolWeight_> (51)
244.20468

>  <Item Name> (51)
Azacitidine (Vidaza)

>  <Catalog Number> (51)
S1782

>  <Synonyms> (51)
5-azacytidine, Mylosar, Ladakamycin 

>  <Target> (51)
DNA/RNA Synthesis

>  <Form> (51)
Free Base

>  <URL> (51)
http://www.selleckchem.com/products/Azacitidine(Vidaza).html

>  <CAS Number> (51)
320-67-2

$$$$
Baricitinib.cdx
csChFnd80/10301815042D

 26 29  0  0  0  0  0  0  0  0999 V2000
    5.7433    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7533    0.4101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7634    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7533    2.3900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4211    0.7724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7734    0.4101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0688    1.1347    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7734    2.3899    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3907    2.1709    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7551    3.4183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7450    4.4083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9924    3.7727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.6755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0880    8.5566    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3950    8.0549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6140    6.6721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5260    5.7911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2190    6.2928    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6424    8.6905    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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>  <Mol_ID> (52)
52

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C16H17N7O2S
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Baricitinib (LY3009104)

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S2851

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INCB 28050

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JAK

>  <Form> (52)
Free Base

>  <URL> (52)
http://www.selleckchem.com/products/baricitinib-ly3009104.html

>  <CAS Number> (52)
1187594-09-7

$$$$
Metformin hydrochloride.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (53)
53

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C4H12ClN5

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C4H12ClN5
C4H12ClN5

>  <MolWeight_> (53)
165.62458

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Metformin hydrochloride (Glucophage)

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S1950

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Glucophage, Riomet, Diabex

>  <Target> (53)
Others

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Hydrochloride

>  <URL> (53)
http://www.selleckchem.com/products/Metformin-hydrochloride(Glucophage).html

>  <CAS Number> (53)
1115-70-4

$$$$
Sodium butyrate.cdx
csChFnd80/10301815042D

  7  5  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
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M  END
>  <Mol_ID> (54)
54

>  <Formula> (54)
C4H7NaO2

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110.08695

>  <Formula_> (54)
C4H7NaO2
C4H7NaO2

>  <MolWeight_> (54)
110.08695

>  <Item Name> (54)
Sodium butyrate

>  <Catalog Number> (54)
S1999

>  <Synonyms> (54)
Butyric acid sodium salt

>  <Target> (54)
HDAC

>  <Form> (54)
Sodium Salt

>  <URL> (54)
http://www.selleckchem.com/products/Sodium-butyrate.html

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

$$$$
Quercetin.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (55)
55

>  <Formula> (55)
C15H10O7

>  <MolWeight> (55)
302.2357

>  <Formula_> (55)
C15H10O7
C15H10O7

>  <MolWeight_> (55)
302.2357

>  <Item Name> (55)
Quercetin (Sophoretin)

>  <Catalog Number> (55)
S2391

>  <Synonyms> (55)
Meletin, Quercetine

>  <Target> (55)
PI3K, PKC, Src, Sirtuin

>  <Form> (55)
Free Base

>  <URL> (55)
http://www.selleckchem.com/products/Quercetin(Sophoretin).html

>  <CAS Number> (55)
117-39-5

$$$$
KW2449.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (56)
56

>  <Formula> (56)
C20H20N4O

>  <MolWeight> (56)
332.399

>  <Formula_> (56)
C20H20N4O
C20H20N4O

>  <MolWeight_> (56)
332.399

>  <Item Name> (56)
KW 2449

>  <Catalog Number> (56)
S2158

>  <Synonyms> (56)
N/A

>  <Target> (56)
Flt, Bcr-Abl, Aurora Kinase

>  <Form> (56)
Free Base

>  <URL> (56)
http://www.selleckchem.com/products/KW-2449.html

>  <CAS Number> (56)
1000669-72-6

$$$$

csChFnd80/10301815042D

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>  <Mol_ID> (57)
57

>  <Formula> (57)
C24H30ClN3O5

>  <MolWeight> (57)
475.9651

>  <Formula_> (57)
C24H30ClN3O5
C24H30ClN3O5

>  <MolWeight_> (57)
475.9651

>  <Item Name> (57)
ITF2357 (Givinostat)

>  <Catalog Number> (57)
S2170

>  <Synonyms> (57)
N/A 

>  <Target> (57)
HDAC 

>  <Form> (57)
Chloride

>  <URL> (57)
http://www.selleckchem.com/products/ITF2357(Givinostat).html

>  <CAS Number> (57)
732302-99-7

$$$$
Daphnetin.cdx
csChFnd80/10301815042D

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>  <MolWeight_> (62)
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>  <Item Name> (62)
AZ 960

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S2214

>  <Synonyms> (62)
N/A

>  <Target> (62)
JAK

>  <Form> (62)
Free Base

>  <URL> (62)
http://www.selleckchem.com/products/AZ-960.html

>  <CAS Number> (62)
905586-69-8

$$$$
CYT 387.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (63)
63

>  <Formula> (63)
C23H22N6O2

>  <MolWeight> (63)
414.45978

>  <Formula_> (63)
C23H22N6O2
C23H22N6O2

>  <MolWeight_> (63)
414.45978

>  <Item Name> (63)
Momelotinib (CYT387)

>  <Catalog Number> (63)
S2219

>  <Synonyms> (63)
CYT 11387 

>  <Target> (63)
JAK 

>  <Form> (63)
Free Base

>  <URL> (63)
http://www.selleckchem.com/products/Cyt387.html

>  <CAS Number> (63)
1056634-68-4

$$$$
(-)-Epigallocatechin gallate.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (64)
64

>  <Formula> (64)
C22H18O11

>  <MolWeight> (64)
458.37172

>  <Formula_> (64)
C22H18O11
C22H18O11

>  <MolWeight_> (64)
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>  <Item Name> (64)
(-)-Epigallocatechin gallate

>  <Catalog Number> (64)
S2250

>  <Synonyms> (64)
EGCG

>  <Target> (64)
DNA Methyltransferase,HER2,Telomerase,EGFR

>  <Form> (64)
Free Base

>  <URL> (64)
http://www.selleckchem.com/products/(-)-Epigallocatechin-gallate.html

>  <CAS Number> (64)
989-51-5

$$$$
Fisetin.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (65)
65

>  <Formula> (65)
C15H10O6

>  <MolWeight> (65)
286.2363

>  <Formula_> (65)
C15H10O6
C15H10O6

>  <MolWeight_> (65)
286.2363

>  <Item Name> (65)
Fisetin (Fustel)

>  <Catalog Number> (65)
S2298

>  <Synonyms> (65)
Fustel, Viset

>  <Target> (65)
Sirtuin

>  <Form> (65)
Free Base

>  <URL> (65)
http://www.selleckchem.com/products/Fisetin(Fustel).html

>  <CAS Number> (65)
528-48-3

$$$$
Parthenolide.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (66)
66

>  <Formula> (66)
C15H20O3

>  <MolWeight> (66)
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>  <Formula_> (66)
C15H20O3
C15H20O3

>  <MolWeight_> (66)
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>  <Item Name> (66)
Parthenolide ((-)-Parthenolide)

>  <Catalog Number> (66)
S2341

>  <Synonyms> (66)
N/A 

>  <Target> (66)
HDAC,NF-¦ÊB,Mdm2,p53

>  <Form> (66)
Free Base

>  <URL> (66)
http://www.selleckchem.com/products/Parthenolide((-)-Parthenolide).html

>  <CAS Number> (66)
20554-84-1

$$$$
Curcumol.cdx
csChFnd80/10301815042D

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JAK

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Free Base

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http://www.selleckchem.com/products/Curcumol.html

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4871-97-0

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>  <Synonyms> (68)
N/A

>  <Target> (68)
Aurora Kinase

>  <Form> (68)
Free Base

>  <URL> (68)
http://www.selleckchem.com/products/tak-901.html

>  <CAS Number> (68)
934541-31-8

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N/A

>  <Target> (69)
Flt, JAK, c-RET

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>  <URL> (69)
http://www.selleckchem.com/products/tg101209.html

>  <CAS Number> (69)
936091-14-4

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>  <Synonyms> (70)
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>  <Target> (70)
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>  <Form> (70)
Free Base

>  <URL> (70)
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Tofacitinib citrate (CP-690550 citrate)

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S5001

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N/A 

>  <Target> (71)
JAK

>  <Form> (71)
Citrate

>  <URL> (71)
http://www.selleckchem.com/products/CP-690550.html

>  <CAS Number> (71)
540737-29-9

$$$$
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Phenformin hydrochloride 

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S2542

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N/A

>  <Target> (72)
AMPK

>  <Form> (72)
Hydrochloride 

>  <URL> (72)
http://www.selleckchem.com/products/Phenformin-hydrochloride.html

>  <CAS Number> (72)
834-28-6

$$$$
Curcumin.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (73)
73

>  <Formula> (73)
C21H20O6

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368.3799

>  <Formula_> (73)
C21H20O6
C21H20O6

>  <MolWeight_> (73)
368.3799

>  <Item Name> (73)
Curcumin

>  <Catalog Number> (73)
S1848

>  <Synonyms> (73)
Diferuloylmethane, Natural Yellow 3, C.I. 75300 

>  <Target> (73)
NF-¦ÊB,Histone Acetyltransferase,Nrf2

>  <Form> (73)
Free Base

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

>  <CAS Number> (73)
458-37-7

$$$$
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csChFnd80/10301815042D

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74

>  <Formula> (74)
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>  <Formula_> (74)
C20H12N2O3S
C20H12N2O3S

>  <MolWeight_> (74)
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>  <Item Name> (74)
A-769662

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S2697

>  <Synonyms> (74)
N/A

>  <Target> (74)
AMPK

>  <Form> (74)
Free Base

>  <URL> (74)
http://www.selleckchem.com/products/a-769662.html

>  <CAS Number> (74)
844499-71-4

$$$$
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Aurora Kinase

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http://www.selleckchem.com/products/gsk1070916.html

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942918-07-2

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TG101348.cdx
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Fedratinib (SAR302503, TG101348)

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N/A

>  <Target> (76)
JAK 

>  <Form> (76)
Free Base

>  <URL> (76)
http://www.selleckchem.com/products/tg-101348.html

>  <CAS Number> (76)
936091-26-8

$$$$
MK-5108.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (77)
77

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>  <Target> (77)
Aurora Kinase

>  <Form> (77)
Free Base

>  <URL> (77)
http://www.selleckchem.com/products/mk-5108-vx-689.html

>  <CAS Number> (77)
1010085-13-8

$$$$
Tubastatin A hydrochloride.cdx
csChFnd80/10301815042D

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>  <Synonyms> (78)
N/A

>  <Target> (78)
HDAC

>  <Form> (78)
Hydrochloride

>  <URL> (78)
http://www.selleckchem.com/products/tubastatin-a-hcl.html

>  <CAS Number> (78)
1310693-92-5

$$$$
Procarbazine Hydrochloride.cdx
csChFnd80/10301815042D

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Hydrochloride

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http://www.selleckchem.com/products/procarbazine-hydrochloride-matulane.html

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366-70-1

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Aurora Kinase

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Free Base

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Transferases

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Sirtuin 

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http://www.selleckchem.com/products/sirtinol.html

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410536-97-9

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JAK

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Free Base

>  <URL> (89)
http://www.selleckchem.com/products/cep33779.html

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1257704-57-6

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HDAC

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Free Base

>  <URL> (90)
http://www.selleckchem.com/products/ci994-tacedinaline.html

>  <CAS Number> (90)
112522-64-2

$$$$
Entacapone.cdx
csChFnd80/10301815042D

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Histone Methyltransferase

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>  <URL> (91)
http://www.selleckchem.com/products/entacapone.html

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130929-57-6

$$$$
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JAK, EGFR

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>  <URL> (92)
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211555-04-3

$$$$
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p53

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2627-69-2

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M  END
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N/A

>  <Target> (103)
Histone Methyltransferase

>  <Form> (103)
Free Base

>  <URL> (103)
http://www.selleckchem.com/products/epz-5676.html

>  <CAS Number> (103)
1380288-87-8

$$$$
(+)-JQ1.cdx
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>  <Mol_ID> (104)
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(+)-JQ1

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S7110

>  <Synonyms> (104)
N/A

>  <Target> (104)
BET

>  <Form> (104)
Free Base

>  <URL> (104)
http://www.selleckchem.com/products/jq1.html

>  <CAS Number> (104)
1268524-70-4

$$$$
GSK J4 HCL.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (105)
105

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>  <MolWeight_> (105)
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>  <Item Name> (105)
GSK J4 HCl

>  <Catalog Number> (105)
S7070

>  <Synonyms> (105)
N/A

>  <Target> (105)
Histone Demethylase

>  <Form> (105)
Hydrochloride

>  <URL> (105)
http://www.selleckchem.com/products/gsk-j4-hcl.html

>  <CAS Number> (105)
1373423-53-0(free base)

$$$$
Pirarubicin.cdx
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M  END
>  <Mol_ID> (106)
106

>  <Formula> (106)
C32H37NO12

>  <MolWeight> (106)
627.63568

>  <Formula_> (106)
C32H37NO12
C32H37NO12

>  <MolWeight_> (106)
627.63568

>  <Item Name> (106)
Pirarubicin

>  <Catalog Number> (106)
S1393

>  <Synonyms> (106)
N/A

>  <Target> (106)
Topoisomerase

>  <Form> (106)
Free Base

>  <URL> (106)
http://www.selleckchem.com/products/Pirarubicin.html

>  <CAS Number> (106)
72496-41-4

$$$$
sodium phenylbutyrate.cdx
csChFnd80/10301815042D

 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
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    1.2124    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (107)
107

>  <Formula> (107)
C10H11NaO2

>  <MolWeight> (107)
186.18291

>  <Formula_> (107)
C10H11NaO2
C10H11NaO2

>  <MolWeight_> (107)
186.18291

>  <Item Name> (107)
Sodium Phenylbutyrate

>  <Catalog Number> (107)
S4125

>  <Synonyms> (107)
N/A

>  <Target> (107)
HDAC

>  <Form> (107)
Sodium Salt

>  <URL> (107)
https://www.selleckchem.com/products/sodium-phenylbutyrate.html

>  <CAS Number> (107)
1716-12-7

$$$$
Zebularine.cdx
csChFnd80/10301815042D

 16 17  0  0  0  0  0  0  0  0999 V2000
    1.3523    2.1729    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.7772    2.1729    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5647    2.8729    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    3.9353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  CFW   2 BOND_GSTEREO 5
M  END
>  <Mol_ID> (108)
108

>  <Formula> (108)
C9H12N2O5

>  <MolWeight> (108)
228.20198

>  <Formula_> (108)
C9H12N2O5
C9H12N2O5

>  <MolWeight_> (108)
228.20198

>  <Item Name> (108)
Zebularine

>  <Catalog Number> (108)
S7113

>  <Synonyms> (108)
N/A

>  <Target> (108)
DNA Methyltransferase

>  <Form> (108)
Free Base

>  <URL> (108)
https://www.selleckchem.com/products/zebularine.html

>  <CAS Number> (108)
3690-10-6

$$$$
AZD 2461.cdx
csChFnd80/10301815042D

 29 32  0  0  0  0  0  0  0  0999 V2000
    0.0000    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  5  1  0  0  0  0
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 27 21  1  0  0  0  0
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 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (109)
109

>  <Formula> (109)
C22H22FN3O3

>  <MolWeight> (109)
395.4267832

>  <Formula_> (109)
C22H22FN3O3
C22H22FN3O3

>  <MolWeight_> (109)
395.4267832

>  <Item Name> (109)
AZD2461

>  <Catalog Number> (109)
S7029

>  <Synonyms> (109)
N/A

>  <Target> (109)
PARP

>  <Form> (109)
Free Base

>  <URL> (109)
https://www.selleckchem.com/products/azd2461.html

>  <CAS Number> (109)
1174043-16-3

$$$$
Scriptaid (GCK 1026).cdx
csChFnd80/10301815042D

 24 26  0  0  0  0  0  0  0  0999 V2000
    2.4165    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  5  1  0  0  0  0
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 22 24  1  0  0  0  0
M  END
>  <Mol_ID> (110)
110

>  <Formula> (110)
C18H18N2O4

>  <MolWeight> (110)
326.34652

>  <Formula_> (110)
C18H18N2O4
C18H18N2O4

>  <MolWeight_> (110)
326.34652

>  <Item Name> (110)
Scriptaid 

>  <Catalog Number> (110)
S8043

>  <Synonyms> (110)
Scriptide, GCK 1026

>  <Target> (110)
HDAC

>  <Form> (110)
Free Base

>  <URL> (110)
https://www.selleckchem.com/products/scriptaid.html

>  <CAS Number> (110)
287383-59-9

$$$$
EPZ004777.cdx
csChFnd80/10301815042D

 39 42  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (111)
111

>  <Formula> (111)
C28H41N7O4

>  <MolWeight> (111)
539.66964

>  <Formula_> (111)
C28H41N7O4
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>  <MolWeight_> (111)
539.66964

>  <Item Name> (111)
EPZ004777

>  <Catalog Number> (111)
S7353

>  <Synonyms> (111)
N/A

>  <Target> (111)
Histone Methyltransferase

>  <Form> (111)
Free Base

>  <URL> (111)
https://www.selleckchem.com/products/epz004777.html

>  <CAS Number> (111)
1338466-77-5

$$$$
Coumarin.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (112)
112

>  <Formula> (112)
C9H6O2

>  <MolWeight> (112)
146.14274

>  <Formula_> (112)
C9H6O2
C9H6O2

>  <MolWeight_> (112)
146.14274

>  <Item Name> (112)
Coumarin

>  <Catalog Number> (112)
S4170

>  <Synonyms> (112)
N/A

>  <Target> (112)
PARP

>  <Form> (112)
Free Base

>  <URL> (112)
http://www.selleckchem.com/products/coumarin.html

>  <CAS Number> (112)
91-64-5

$$$$
4SC-201(resminostat,BYK408740).cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (113)
113

>  <Formula> (113)
C16H19N3O4S

>  <MolWeight> (113)
349.40476

>  <Formula_> (113)
C16H19N3O4S
C16H19N3O4S

>  <MolWeight_> (113)
349.40476

>  <Item Name> (113)
Resminostat (RAS2410)

>  <Catalog Number> (113)
S2693

>  <Synonyms> (113)
4SC-201, BYK408740

>  <Target> (113)
HDAC

>  <Form> (113)
Free Base

>  <URL> (113)
http://www.selleckchem.com/products/resminostat-ras2410.html

>  <CAS Number> (113)
864814-88-0

$$$$
Bromosporine.cdx
csChFnd80/10301815042D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (114)
114

>  <Formula> (114)
C17H20N6O4S

>  <MolWeight> (114)
404.4435

>  <Formula_> (114)
C17H20N6O4S
C17H20N6O4S

>  <MolWeight_> (114)
404.4435

>  <Item Name> (114)
Bromosporine

>  <Catalog Number> (114)
S7233

>  <Synonyms> (114)
N/A

>  <Target> (114)
Epigenetic Reader Domain

>  <Form> (114)
Free Base

>  <URL> (114)
http://www.selleckchem.com/products/bromosporine.html

$$$$
192441-08-0.cdx
csChFnd80/10301815042D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (115)
115

>  <Formula> (115)
C10H8BrN5OS

>  <MolWeight> (115)
326.17242

>  <Formula_> (115)
C10H8BrN5OS
C10H8BrN5OS

>  <MolWeight_> (115)
326.17242

>  <Item Name> (115)
Lomeguatrib

>  <Catalog Number> (115)
S8056

>  <Synonyms> (115)
PaTrin-2

>  <Target> (115)
DNA Methyltransferase

>  <Form> (115)
Free Base

>  <URL> (115)
http://www.selleckchem.com/products/lomeguatrib.html

>  <CAS Number> (115)
192441-08-0

$$$$
S4246.cdx
csChFnd80/10301815042D

 12 11  0  0  0  0  0  0  0  0999 V2000
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A   12
relative stereochemistry
M  END
>  <Mol_ID> (116)
116

>  <Formula> (116)
C9H12ClNR

>  <MolWeight> (116)
169.65128

>  <Formula_> (116)
C9H12ClNR
C9H12ClNR

>  <MolWeight_> (116)
169.65128

>  <Item Name> (116)
Tranylcypromine (2-PCPA) HCl

>  <Catalog Number> (116)
S4246

>  <Synonyms> (116)
N/A

>  <Target> (116)
MAO

>  <Form> (116)
Hydrochloride

>  <URL> (116)
http://www.selleckchem.com/products/tranylcypromine-2-pcpa-hcl.html

>  <CAS Number> (116)
4548-34-9

$$$$
EPZ005687.cdx
csChFnd80/10301815042D

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EPZ005687

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S7004

>  <Synonyms> (117)
N/A

>  <Target> (117)
Histone Methyltransferase

>  <Form> (117)
Free Base

>  <URL> (117)
http://www.selleckchem.com/products/epz005687.html

>  <CAS Number> (117)
1396772-26-1

$$$$
AZD 1480.cdx
csChFnd80/10301815042D

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118

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C14H14ClFN8
C14H14ClFN8

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AZD1480

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S2162

>  <Synonyms> (118)
N/A

>  <Target> (118)
JAK

>  <Form> (118)
Free Base

>  <URL> (118)
http://www.selleckchem.com/products/AZD1480.html

>  <CAS Number> (118)
935666-88-9, 1260222-79-4 (TFA)

$$$$
GSK525762 (I-BET-762).cdx
csChFnd80/10301815042D

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119

>  <Formula> (119)
C22H22ClN5O2

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I-BET-762

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GSK525762, GSK525762A

>  <Target> (119)
Epigenetic Reader Domain

>  <Form> (119)
Free Base

>  <URL> (119)
http://www.selleckchem.com/products/i-bet-762.html

>  <CAS Number> (119)
1260907-17-2

$$$$
RGFP966.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (120)
120

>  <Formula> (120)
C21H19FN4O

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362.4001632

>  <Formula_> (120)
C21H19FN4O
C21H19FN4O

>  <MolWeight_> (120)
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>  <Item Name> (120)
RGFP966

>  <Catalog Number> (120)
S7229

>  <Synonyms> (120)
N/A

>  <Target> (120)
HDAC

>  <Form> (120)
Free Base

>  <URL> (120)
http://www.selleckchem.com/products/rgfp966.html

>  <CAS Number> (120)
1396841-57-8

$$$$
ZM39923 HCl.cdx
csChFnd80/10301815042D

 26 27  0  0  0  0  0  0  0  0999 V2000
    7.2746    4.9000    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
    4.8497    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    6.3000    0.0000 O   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
    8.4870    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.9000    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    2.8000    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
   12.1244    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
    9.6995    0.7000    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
    3.6373    4.2000    0.0000 N   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
    2.4249    6.3000    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    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
    2.4249    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
    0.0000    0.7000    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    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7377    0.0634    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
  1  4  2  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  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  2  0  0  0  0
 13 14  1  0  0  0  0
  5 14  2  0  0  0  0
  9 14  1  0  0  0  0
  1  6  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 15 16  1  0  0  0  0
 19 20  1  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 25  1  0  0  0  0
 20 25  2  0  0  0  0
 15 19  1  0  0  0  0
  3 15  1  0  0  0  0
M  END
>  <Mol_ID> (121)
121

>  <Formula> (121)
C23H26ClNO

>  <MolWeight> (121)
367.91164

>  <Formula_> (121)
C23H26ClNO
C23H26ClNO

>  <MolWeight_> (121)
367.91164

>  <Item Name> (121)
ZM 39923 HCl

>  <Catalog Number> (121)
S8004

>  <Synonyms> (121)
N/A

>  <Target> (121)
JAK

>  <Form> (121)
HCl

>  <URL> (121)
http://www.selleckchem.com/products/zm-39923-hcl.html

>  <CAS Number> (121)
1021868-92-7

$$$$
SGC 0946.cdx
csChFnd80/10301815042D

 40 43  0  0  0  0  0  0  0  0999 V2000
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    2.4248    0.7024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6414    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8579    0.7024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8579    2.1071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6414    2.8094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5124    1.5947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9124    4.0195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0704    0.0024    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2827    0.7023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2827    2.1023    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4951    0.0024    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7075    0.7023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7075    2.1023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9199    2.8023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9199    4.2022    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7075    4.9022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4951    4.2022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7075    6.3021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1323    4.9022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3797    4.2666    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.5994    2.8791    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   14.9869    2.6593    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   15.6246    3.9110    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   14.6313    4.9042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0074    4.1300    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.6095    1.8892    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6224    1.4120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0007    3.1366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2524    3.7744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0325    5.1619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6451    5.3817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9273    1.7338    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.1054    0.9687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3570    1.6065    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.4306    3.0093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6779    3.6448    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.0224    6.1518    0.0000 Br  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
  7  9  1  0  0  0  0
  7 10  1  0  0  0  0
  4 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  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
 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
 19 21  1  0  0  0  0
 18 22  1  0  0  0  0
 23 22  1  1  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 23  1  0  0  0  0
 26 28  1  1  0  0  0
 24 29  1  6  0  0  0
 25 30  1  6  0  0  0
 28 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 28  1  0  0  0  0
 31 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 37  1  0  0  0  0
 37 38  2  0  0  0  0
 38 32  1  0  0  0  0
 38 39  1  0  0  0  0
 33 40  1  0  0  0  0
M  END
>  <Mol_ID> (122)
122

>  <Formula> (122)
C28H40BrN7O4

>  <MolWeight> (122)
618.5657

>  <Formula_> (122)
C28H40BrN7O4
C28H40BrN7O4

>  <MolWeight_> (122)
618.5657

>  <Item Name> (122)
SGC 0946

>  <Catalog Number> (122)
S7079

>  <Synonyms> (122)
N/A

>  <Target> (122)
Histone Methyltransferase

>  <Form> (122)
Free Base

>  <URL> (122)
http://www.selleckchem.com/products/sgc-0946.html

$$$$
Ro 31-8220 mesylate.cdx
csChFnd80/10301815042D

 38 41  0  0  0  0  0  0  0  0999 V2000
   10.3410    6.1078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9738    6.4088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5518    7.7403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4906    8.7679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8477    8.4691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2671    7.1457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8380    5.5844    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7077    6.4095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1569    7.7503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3432    8.8896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8062   10.2329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8380    4.1844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0499    3.4847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.1408   10.6558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6652   11.0566    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3107    6.4217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7353    7.7490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7920    8.7904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4517    5.6058    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5882    6.4395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1578    7.7528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9778    8.8876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5331   10.2390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2014   10.6711    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4517    4.2058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4746    2.0845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4746    3.4844    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.6871    1.3844    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0533    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0533    1.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.6533    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4533    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0533    2.8000    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
  9 10  1  0  0  0  0
 10 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  2  0  0  0  0
 11 17  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
 25 26  2  0  0  0  0
 26 22  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 17 28  1  0  0  0  0
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 24 30  1  0  0  0  0
 15 31  1  0  0  0  0
 31 32  2  0  0  0  0
 31 33  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 35 37  2  0  0  0  0
 35 38  1  0  0  0  0
M  END
>  <Mol_ID> (123)
123

>  <Formula> (123)
C26H27N5O5S2

>  <MolWeight> (123)
553.65308

>  <Formula_> (123)
C26H27N5O5S2
C26H27N5O5S2

>  <MolWeight_> (123)
553.65308

>  <Item Name> (123)
Ro 31-8220 Mesylate

>  <Catalog Number> (123)
S7207

>  <Synonyms> (123)
Bisindolylmaleimide IX Mesylate

>  <Target> (123)
PKC

>  <Form> (123)
Mesylate

>  <URL> (123)
http://www.selleckchem.com/products/ro-31-8220-mesylate.html

>  <CAS Number> (123)
138489-18-6

$$$$
SGI-1027.cdx
csChFnd80/10301815042D

 35 39  0  0  0  0  0  0  0  0999 V2000
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   15.7617    2.8000    0.0000 N   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
   18.1865    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (124)
124

>  <Formula> (124)
C27H23N7O

>  <MolWeight> (124)
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>  <Formula_> (124)
C27H23N7O
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>  <MolWeight_> (124)
461.51782

>  <Item Name> (124)
SGI-1027

>  <Catalog Number> (124)
S7276

>  <Synonyms> (124)
DNA Methyltransferase Inhibitor II

>  <Target> (124)
DNA Methyltransferase

>  <Form> (124)
Free Base

>  <URL> (124)
http://www.selleckchem.com/products/sgi-1027.html

>  <CAS Number> (124)
1020149-73-8

$$$$
Dorsomorphin dihydrochloride(BML-275,Compound C).cdx
csChFnd80/10301815042D

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>  <Mol_ID> (125)
125

>  <Formula> (125)
C24H27Cl2N5O

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>  <Formula_> (125)
C24H27Cl2N5O
C24H27Cl2N5O

>  <MolWeight_> (125)
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>  <Item Name> (125)
Dorsomorphin (Compound C) 2HCl

>  <Catalog Number> (125)
S7306

>  <Synonyms> (125)
BML-275,Compound C

>  <Target> (125)
AMPK

>  <Form> (125)
Dihydrochloride

>  <URL> (125)
http://www.selleckchem.com/products/dorsomorphin-2hcl.html

>  <CAS Number> (125)
1219168-18-9

$$$$
EPZ-6438 (E7438).cdx
csChFnd80/10301815042D

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>  <Mol_ID> (126)
126

>  <Formula> (126)
C34H44N4O4

>  <MolWeight> (126)
572.73756

>  <Formula_> (126)
C34H44N4O4
C34H44N4O4

>  <MolWeight_> (126)
572.73756

>  <Item Name> (126)
Tazemetostat (EPZ-6438)

>  <Catalog Number> (126)
S7128

>  <Synonyms> (126)
E7438

>  <Target> (126)
Histone Methyltransferase

>  <Form> (126)
Free Base

>  <URL> (126)
http://www.selleckchem.com/products/epz-6438.html

>  <CAS Number> (126)
1403254-99-8

$$$$
RVX-208(RVX-000222).cdx
csChFnd80/10301815042D

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>  <Mol_ID> (127)
127

>  <Formula> (127)
C20H22N2O5

>  <MolWeight> (127)
370.39908

>  <Formula_> (127)
C20H22N2O5
C20H22N2O5

>  <MolWeight_> (127)
370.39908

>  <Item Name> (127)
RVX-208(RVX-000222)

>  <Catalog Number> (127)
S7295

>  <Synonyms> (127)
RVX-000222

>  <Target> (127)
Epigenetic Reader Domain

>  <Form> (127)
Free Base

>  <URL> (127)
http://www.selleckchem.com/products/rvx-208.html

>  <CAS Number> (127)
1044870-39-4

$$$$
XL019.cdx
csChFnd80/10301815042D

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JAK

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http://www.selleckchem.com/products/xl019.html

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945755-56-6

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Histone Methyltransferase

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http://www.selleckchem.com/products/unc1999.html

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1431612-23-5

$$$$
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Histone demethylases

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Free Base

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http://www.selleckchem.com/products/jib-04.html

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199596-05-9

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HMTase Inhibitor IX

>  <Target> (131)
Histone Methyltransferase

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Free Base

>  <URL> (131)
http://www.selleckchem.com/products/mm-102.html

>  <CAS Number> (131)
1417329-24-8

$$$$
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csChFnd80/10301815042D

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>  <Synonyms> (132)
N/A

>  <Target> (132)
JAK

>  <Form> (132)
Free Base

>  <URL> (132)
http://www.selleckchem.com/products/pacritinib-sb1518.html

>  <CAS Number> (132)
937272-79-2

$$$$
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csChFnd80/10301815042D

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N/A

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HDAC

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Free Base

>  <URL> (133)
http://www.selleckchem.com/products/rg2833-rgfp109.html

>  <CAS Number> (133)
1215493-56-3

$$$$
WZ4003.cdx
csChFnd80/10301815042D

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AMPK

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Free Base

>  <URL> (134)
http://www.selleckchem.com/products/wz4003.html

>  <CAS Number> (134)
1214265-58-3

$$$$
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csChFnd80/10301815042D

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1357302-64-7

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Histone Acetyltransferase

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>  <Mol_ID> (144)
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Tenovin-6

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S4900

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N/A

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p53,Sirtuin

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Free Base

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http://www.selleckchem.com/products/tenovin-6.html

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1011557-82-6

$$$$
IOX1.cdx
csChFnd80/10301815042D

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IOX1

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N/A

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Histone demethylases

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Free Base

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http://www.selleckchem.com/products/iox1.html

>  <CAS Number> (145)
5852-78-8

$$$$
AZD1208.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (146)
146

>  <Formula> (146)
C21H21N3O2S

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>  <Formula_> (146)
C21H21N3O2S
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>  <MolWeight_> (146)
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AZD1208

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S7104

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N/A

>  <Target> (146)
Pim

>  <Form> (146)
Free Base

>  <URL> (146)
http://www.selleckchem.com/products/azd-1208.html

>  <CAS Number> (146)
1204144-28-4

$$$$
CX-6258 HCl .cdx
csChFnd80/10301815042D

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>  <Mol_ID> (147)
147

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C26H25Cl2N3O3

>  <MolWeight> (147)
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>  <MolWeight_> (147)
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>  <Item Name> (147)
CX-6258 HCl

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S7041

>  <Synonyms> (147)
N/A

>  <Target> (147)
Pim

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Hydrochloride

>  <URL> (147)
http://www.selleckchem.com/products/CX-6258.html

>  <CAS Number> (147)
1353859-00-3

$$$$
CPI203 .cdx
csChFnd80/10301815042D

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Epigenetic Reader Domain

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Free Base

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http://www.selleckchem.com/products/cpi-203.html

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1446144-04-2

$$$$
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>  <Target> (149)
HDAC

>  <Form> (149)
Free Base

>  <URL> (149)
http://www.selleckchem.com/products/tmp269.html

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1314890-29-3

$$$$
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csChFnd80/10301815042D

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>  <MolWeight_> (150)
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MG149

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S7476

>  <Synonyms> (150)
N/A

>  <Target> (150)
Histone Acetyltransferase

>  <Form> (150)
Free Base

>  <URL> (150)
http://www.selleckchem.com/products/mg149.html

>  <CAS Number> (150)
1243583-85-8

$$$$
Go6976.cdx
csChFnd80/10301815042D

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C24H18N4O

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PKC

>  <Form> (151)
Free Base

>  <URL> (151)
http://www.selleckchem.com/products/go6976.html

>  <CAS Number> (151)
136194-77-9

$$$$
Procainamide hydrochloride.cdx
csChFnd80/10301815042D

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Procainamide HCl

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S4294

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N/A

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Sodium Channel

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>  <URL> (152)
http://www.selleckchem.com/products/procainamide-hcl.html

>  <CAS Number> (152)
614-39-1

$$$$
Daptomycin.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (153)
153

>  <Formula> (153)
C72H101N17O26

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>  <Formula_> (153)
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>  <MolWeight_> (153)
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>  <Item Name> (153)
Daptomycin

>  <Catalog Number> (153)
S1373

>  <Synonyms> (153)
LY146032

>  <Target> (153)
Others

>  <Form> (153)
Free Base

>  <URL> (153)
http://www.selleckchem.com/products/Daptomycin.html

>  <CAS Number> (153)
103060-53-3

$$$$
R-Ruxolitinib.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (154)
154

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>  <Formula_> (154)
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>  <MolWeight_> (154)
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>  <Item Name> (154)
Ruxolitinib (INCB018424)

>  <Catalog Number> (154)
S1378

>  <Synonyms> (154)
N/A

>  <Target> (154)
JAK

>  <Form> (154)
Free Base

>  <URL> (154)
http://www.selleckchem.com/products/INCB18424.html

>  <CAS Number> (154)
941678-49-5

$$$$
CAY10683 (Santacruzamate A).cdx
csChFnd80/10301815042D

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   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
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   10.9119    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    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
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M  END
>  <Mol_ID> (155)
155

>  <Formula> (155)
C15H22N2O3

>  <MolWeight> (155)
278.34678

>  <Formula_> (155)
C15H22N2O3
C15H22N2O3

>  <MolWeight_> (155)
278.34678

>  <Item Name> (155)
Santacruzamate A (CAY10683)

>  <Catalog Number> (155)
S7595

>  <Synonyms> (155)
N/A

>  <Target> (155)
HDAC

>  <Form> (155)
Free Base

>  <URL> (155)
http://www.selleckchem.com/products/santacruzamate-a-cay10683.html

>  <CAS Number> (155)
1477949-42-0

$$$$
filgotinib.cdx
csChFnd80/10301815042D

 30 34  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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 12  7  1  0  0  0  0
  4 13  2  0  0  0  0
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 15  5  1  0  0  0  0
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 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
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 28 23  1  0  0  0  0
 26 29  2  0  0  0  0
 26 30  2  0  0  0  0
M  END
>  <Mol_ID> (156)
156

>  <Formula> (156)
C21H23N5O3S

>  <MolWeight> (156)
425.50402

>  <Formula_> (156)
C21H23N5O3S
C21H23N5O3S

>  <MolWeight_> (156)
425.50402

>  <Item Name> (156)
Filgotinib£¨GLPG0643)

>  <Catalog Number> (156)
S7605

>  <Synonyms> (156)
N/A

>  <Target> (156)
JAK

>  <Form> (156)
Free Base

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

>  <CAS Number> (156)
1206161-97-8

$$$$
PFI-3.cdx
csChFnd80/10301815042D

 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
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   12.1244    0.0000    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
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 14 15  1  0  0  0  0
 15 10  1  0  0  0  0
 11 16  1  1  0  0  0
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 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> (157)
157

>  <Formula> (157)
C19H19N3O2

>  <MolWeight> (157)
321.37306

>  <Formula_> (157)
C19H19N3O2
C19H19N3O2

>  <MolWeight_> (157)
321.37306

>  <Item Name> (157)
PFI-3

>  <Catalog Number> (157)
S7315

>  <Synonyms> (157)
N/A

>  <Target> (157)
Epigenetic Reader Domain

>  <Form> (157)
Free Base

>  <URL> (157)
http://www.selleckchem.com/products/pfi-3.html

$$$$
Tasquinimod .cdx
csChFnd80/10301815042D

 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
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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
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  4  7  1  0  0  0  0
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  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
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 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
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 16 17  1  0  0  0  0
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 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> (158)
158

>  <Formula> (158)
C20H17F3N2O4

>  <MolWeight> (158)
406.3551896

>  <Formula_> (158)
C20H17F3N2O4
C20H17F3N2O4

>  <MolWeight_> (158)
406.3551896

>  <Item Name> (158)
Tasquinimod

>  <Catalog Number> (158)
S7617

>  <Synonyms> (158)
ABR-215050

>  <Target> (158)
HDAC

>  <Form> (158)
Free Base

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

>  <CAS Number> (158)
254964-60-8

$$$$
AGK 2.cdx
csChFnd80/10301815042D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (159)
159

>  <Formula> (159)
C23H13Cl2N3O2

>  <MolWeight> (159)
434.27422

>  <Formula_> (159)
C23H13Cl2N3O2
C23H13Cl2N3O2

>  <MolWeight_> (159)
434.27422

>  <Item Name> (159)
AGK2

>  <Catalog Number> (159)
S7577

>  <Synonyms> (159)
N/A

>  <Target> (159)
Sirtuin

>  <Form> (159)
Free Base

>  <URL> (159)
http://www.selleckchem.com/products/agk2.html

>  <CAS Number> (159)
304896-28-4

$$$$
Anacardic Acid.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (160)
160

>  <Formula> (160)
C22H36O3

>  <MolWeight> (160)
348.51944

>  <Formula_> (160)
C22H36O3
C22H36O3

>  <MolWeight_> (160)
348.51944

>  <Item Name> (160)
Anacardic Acid

>  <Catalog Number> (160)
S7582

>  <Synonyms> (160)
6-pentadecylsalicylic Acid

>  <Target> (160)
Histone Acetyltransferase

>  <Form> (160)
Free Base

>  <URL> (160)
http://www.selleckchem.com/products/anacardic-acid.html

>  <CAS Number> (160)
16611-84-0

$$$$
Splitomicin.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (161)
161

>  <Formula> (161)
C13H10O2

>  <MolWeight> (161)
198.2173

>  <Formula_> (161)
C13H10O2
C13H10O2

>  <MolWeight_> (161)
198.2173

>  <Item Name> (161)
Splitomicin

>  <Catalog Number> (161)
S7593

>  <Synonyms> (161)
N/A

>  <Target> (161)
Sirtuin

>  <Form> (161)
Free Base

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

>  <CAS Number> (161)
5690-03-9

$$$$
PFI-2.cdx
csChFnd80/10301815042D

 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
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    3.6373    1.4544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (162)
162

>  <Formula> (162)
C23H25F4N3O3S

>  <MolWeight> (162)
499.5215128

>  <Formula_> (162)
C23H25F4N3O3S
C23H25F4N3O3S

>  <MolWeight_> (162)
499.5215128

>  <Item Name> (162)
PFI-2 HCl

>  <Catalog Number> (162)
S7294

>  <Synonyms> (162)
N/A

>  <Target> (162)
Histone Methyltransferase

>  <Form> (162)
Hydrochloride

>  <URL> (162)
http://www.selleckchem.com/products/pfi-2.html

>  <CAS Number> (162)
1627676-59-8

$$$$
MI-3.cdx
csChFnd80/10301815042D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (163)
163

>  <Formula> (163)
C18H25N5S2

>  <MolWeight> (163)
375.5546

>  <Formula_> (163)
C18H25N5S2
C18H25N5S2

>  <MolWeight_> (163)
375.5546

>  <Item Name> (163)
MI-3 (Menin-MLL Inhibitor)

>  <Catalog Number> (163)
S7619

>  <Synonyms> (163)
N/A

>  <Target> (163)
Histone Methyltransferase

>  <Form> (163)
Free Base

>  <URL> (163)
http://www.selleckchem.com/products/mi-3-menin-mll-inhibitor.html

>  <CAS Number> (163)
1271738-59-0

$$$$
Remodelin.cdx
csChFnd80/10301815042D

 21 22  0  0  0  0  0  0  0  0999 V2000
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    6.1263    1.8971    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.0947    2.9080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4325    4.1415    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4819    2.7187    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.0115    1.4228    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.3987    1.2335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0609    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4386    0.2486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6279    1.6358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3671    2.2444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0432    6.3406    0.0000 Br  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
  7  8  3  0  0  0  0
  3  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 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  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  1  0  0  0  0
 20 16  1  0  0  0  0
M  CFW  16 B_NG_STER 2
M  END
>  <Mol_ID> (164)
164

>  <Formula> (164)
C15H15BrN4S

>  <MolWeight> (164)
363.2754

>  <Formula_> (164)
C15H15BrN4S
C15H15BrN4S

>  <MolWeight_> (164)
363.2754

>  <Item Name> (164)
Remodelin

>  <Catalog Number> (164)
S7641

>  <Synonyms> (164)
N/A

>  <Target> (164)
Histone Acetyltransferase

>  <Form> (164)
hydrochloride salt

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

>  <CAS Number> (164)
1622921-15-6

$$$$
Nedaplatin.cdx
csChFnd80/10301815042D
CFW_RXN
  8  6  0  0  0  0  0  0  0  0999 V2000
    3.1062    1.0404    0.0000 Pt  0  0  0  0  0  0  0  5  2  0  0  0
    2.4062    2.2528    0.0000 O   0  0  0  0  0  0  0  5  2  0  0  0
    1.0368    1.9618    0.0000 C   0  0  0  0  0  0  0  5  2  0  0  0
    0.8905    0.5694    0.0000 C   0  0  0  0  0  0  0  5  2  0  0  0
    2.1694    0.0000    0.0000 O   0  0  0  0  0  0  0  5  2  0  0  0
    0.0000    2.8953    0.0000 O   0  0  0  0  0  0  0  5  2  0  0  0
    6.5243    3.4968    0.0000 R   0  0  0  0  0  0  0  1  1  1  0  0
    6.5243    0.0697    0.0000 R   0  0  0  0  0  0  0  2  3  1  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  1  1  0  0  0  0
  3  6  2  0  0  0  0
A    7
;H3N
A    8
;H3N
M  END
>  <Mol_ID> (165)
165

>  <Formula> (165)
R + C2H2O3Pt  -> R  [+ C2H2O3Pt]

>  <MolWeight> (165)
269.11348

>  <Formula_> (165)
R + C2H2O3Pt  -> R  [+ C2H2O3Pt]

>  <MolWeight_> (165)
269.11348

>  <Item Name> (165)
Nedaplatin

>  <Catalog Number> (165)
S1826

>  <Synonyms> (165)
N/A

>  <Target> (165)
DNA/RNA Synthesis

>  <Form> (165)
Free Base

>  <URL> (165)
http://www.selleckchem.com/products/nedaplatin-aqupla.html

>  <CAS Number> (165)
95734-82-0

$$$$
ENMD-2076 L-(+)-Tartaric acid.cdx
csChFnd80/10301815042D

 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
    7.2662    8.7613    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    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
    2.4207    4.5637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    5.2637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.5661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4744    6.6637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6826    7.3613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8909    6.6637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8909    5.2637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1033    4.5637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3157    5.2637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3157    6.6637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1033    7.3637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9635    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1760    2.0951    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.3842    1.3976    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.1760    3.4903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    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
    8.5924    3.4903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3842    0.0024    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
  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
 11 12  2  0  0  0  0
 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
 23 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 23  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  6  0  0  0
 29 33  1  0  0  0  0
 29 34  2  0  0  0  0
 31 35  1  0  0  0  0
 35 36  1  0  0  0  0
 35 37  2  0  0  0  0
 31 38  1  6  0  0  0
M  END
>  <Mol_ID> (166)
166

>  <Formula> (166)
C25H31N7O6

>  <MolWeight> (166)
525.55694

>  <Formula_> (166)
C25H31N7O6
C25H31N7O6

>  <MolWeight_> (166)
525.55694

>  <Item Name> (166)
ENMD-2076 L-(+)-Tartaric acid

>  <Catalog Number> (166)
S2018

>  <Synonyms> (166)
N/A

>  <Target> (166)
FLT3

>  <Form> (166)
Free Base

>  <URL> (166)
http://www.selleckchem.com/products/enmd-2076-l-tartaric-acid.html

>  <CAS Number> (166)
1291074-87-7

$$$$
PJ34.cdx
csChFnd80/10301815042D

 23 24  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
    2.4249    2.8000    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
    4.8497    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    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 N   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
    6.0622    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
    0.0000    2.8000    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
    6.0622    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2000    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
    9.6995    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8142    4.2576    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    0.7000    0.0000 O   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
   10.9119    0.7000    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  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 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 10  1  0  0  0  0
  8 13  2  0  0  0  0
  9 14  1  0  0  0  0
  9 13  1  0  0  0  0
 10 15  2  0  0  0  0
 11 16  2  0  0  0  0
 12 16  1  0  0  0  0
 14 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 17 21  2  0  0  0  0
 19 22  1  0  0  0  0
 19 23  1  0  0  0  0
M  END
>  <Mol_ID> (167)
167

>  <Formula> (167)
C17H18ClN3O2

>  <MolWeight> (167)
331.79672

>  <Formula_> (167)
C17H18ClN3O2
C17H18ClN3O2

>  <MolWeight_> (167)
331.79672

>  <Item Name> (167)
PJ34 hcl

>  <Catalog Number> (167)
S7300

>  <Synonyms> (167)
N/A

>  <Target> (167)
PARP

>  <Form> (167)
Hydrochloride

>  <URL> (167)
http://www.selleckchem.com/products/pj34-hcl.html

>  <CAS Number> (167)
344458-15-7

$$$$
Blasticidin S hydrochloride.cdx
csChFnd80/10301815042D

 31 31  0  0  0  0  0  0  0  0999 V2000
    1.2124    2.3171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.9171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.2171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.9171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.3171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.0171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.4171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.2171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.0171    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.0622    2.3171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.0171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.4171    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.0622    5.1171    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.8497    4.4171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    6.5171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    7.2171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.2171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    5.1171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    4.4171    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.3368    5.1171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    4.4171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    5.1171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    3.0171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    3.0171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    4.4171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    5.1171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    3.0171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    6.5171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7624    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
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  6  7  2  0  0  0  0
  2  8  1  0  0  0  0
  5  9  1  6  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 14  1  0  0  0  0
 14  9  1  0  0  0  0
 13 15  1  6  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 12 18  1  1  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
 19 25  2  0  0  0  0
 21 26  1  6  0  0  0
 24 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  2  0  0  0  0
 24 30  1  0  0  0  0
M  END
>  <Mol_ID> (168)
168

>  <Formula> (168)
C17H27ClN8O5

>  <MolWeight> (168)
458.89988

>  <Formula_> (168)
C17H27ClN8O5
C17H27ClN8O5

>  <MolWeight_> (168)
458.89988

>  <Item Name> (168)
Blasticidin S HCl

>  <Catalog Number> (168)
S7419

>  <Synonyms> (168)
Blasticidine S HCl

>  <Target> (168)
DNA/RNA Synthesis

>  <Form> (168)
hydrochloride salt

>  <URL> (168)
http://www.selleckchem.com/products/blasticidin-s-hcl.html

>  <CAS Number> (168)
3513-03-9

$$$$
Cerdulatinib (PRT-062070).cdx
csChFnd80/10301815042D

 32 34  0  0  0  0  0  0  0  0999 V2000
   12.1244    3.5174    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.1174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    1.4174    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    2.1174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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Cerdulatinib (PRT062070, PRT2070)

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N/A

>  <Target> (169)
JAK

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Hydrochloride

>  <URL> (169)
http://www.selleckchem.com/products/cerdulatinib-prt062070-prt2070.html

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1369761-01-2

$$$$
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Histone Methyltransferase

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Free Base

>  <URL> (170)
http://www.selleckchem.com/products/mi-2-menin-mll-inhibitor.html

>  <CAS Number> (170)
1271738-62-5

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SP2509

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Histone Demethylase

>  <Form> (171)
Free Base

>  <URL> (171)
http://www.selleckchem.com/products/sp2509.html

>  <CAS Number> (171)
1423715-09-6

$$$$
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http://www.selleckchem.com/products/gsk1324726a-i-bet726.html

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1300031-52-0

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M  END
>  <Mol_ID> (173)
173

>  <Formula> (173)
C23H26N4O2

>  <MolWeight> (173)
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>  <Formula_> (173)
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>  <MolWeight_> (173)
390.47814

>  <Item Name> (173)
EI1

>  <Catalog Number> (173)
S7611

>  <Synonyms> (173)
N/A

>  <Target> (173)
Histone Methyltransferase

>  <Form> (173)
Free Base

>  <URL> (173)
http://www.selleckchem.com/products/ei1.html

>  <CAS Number> (173)
1418308-27-6

$$$$
BRD4770.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (174)
174

>  <Formula> (174)
C25H23N3O3

>  <MolWeight> (174)
413.46842

>  <Formula_> (174)
C25H23N3O3
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>  <MolWeight_> (174)
413.46842

>  <Item Name> (174)
BRD4770

>  <Catalog Number> (174)
S7591

>  <Synonyms> (174)
N/A

>  <Target> (174)
Histone Methyltransferase

>  <Form> (174)
Free Base

>  <URL> (174)
http://www.selleckchem.com/products/brd4770.html

>  <CAS Number> (174)
1374601-40-7

$$$$
PX-478 2HCl.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (175)
175

>  <Formula> (175)
C13H20Cl4N2O3

>  <MolWeight> (175)
394.1215

>  <Formula_> (175)
C13H20Cl4N2O3
C13H20Cl4N2O3

>  <MolWeight_> (175)
394.1215

>  <Item Name> (175)
PX-478 2HCl

>  <Catalog Number> (175)
S7612

>  <Synonyms> (175)
N/A

>  <Target> (175)
HIF

>  <Form> (175)
Dihydrochlorid

>  <URL> (175)
http://www.selleckchem.com/products/px-478-2hcl.html

>  <CAS Number> (175)
685898-44-6

$$$$
Reversine.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (176)
176

>  <Formula> (176)
C21H27N7O

>  <MolWeight> (176)
393.48538

>  <Formula_> (176)
C21H27N7O
C21H27N7O

>  <MolWeight_> (176)
393.48538

>  <Item Name> (176)
Reversine

>  <Catalog Number> (176)
S7588

>  <Synonyms> (176)
N/A

>  <Target> (176)
Adenosine Receptor

>  <Form> (176)
Free Base

>  <URL> (176)
http://www.selleckchem.com/products/reversine.html

>  <CAS Number> (176)
656820-32-5

$$$$
CAY10603.cdx
csChFnd80/10301815042D

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S7555

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N/A

>  <Target> (182)
HDAC

>  <Form> (182)
Free Base

>  <URL> (182)
http://www.selleckchem.com/products/4sc-202.html

>  <CAS Number> (182)
910462-43-0

$$$$
OF-1.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (183)
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>  <Formula> (183)
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>  <Formula_> (183)
C17H18BrN3O4S
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>  <MolWeight_> (183)
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>  <Item Name> (183)
OF-1

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S7681

>  <Synonyms> (183)
N/A

>  <Target> (183)
Epigenetic Reader Domain

>  <Form> (183)
Free Base

>  <URL> (183)
http://www.selleckchem.com/products/of-1.html

>  <CAS Number> (183)
919973-83-4

$$$$
UNC0379.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (184)
184

>  <Formula> (184)
C23H35N5O2

>  <MolWeight> (184)
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>  <Formula_> (184)
C23H35N5O2
C23H35N5O2

>  <MolWeight_> (184)
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>  <Item Name> (184)
UNC0379

>  <Catalog Number> (184)
S7570

>  <Synonyms> (184)
N/A

>  <Target> (184)
Histone Methyltransferase

>  <Form> (184)
Free Base

>  <URL> (184)
http://www.selleckchem.com/products/unc0379.html

>  <CAS Number> (184)
1620401-82-2

$$$$
GSK-LSD1  dihydrochloride.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (185)
185

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>  <MolWeight> (185)
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>  <Formula_> (185)
C14H22Cl2N2
C14H22Cl2N2

>  <MolWeight_> (185)
289.24388

>  <Item Name> (185)
GSK-LSD1 2HCl

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S7574

>  <Synonyms> (185)
N/A

>  <Target> (185)
Histone Demethylase

>  <Form> (185)
Dihydrochloride

>  <URL> (185)
http://www.selleckchem.com/products/gsk-lsd1-2hcl.html

>  <CAS Number> (185)
1431368-48-7

$$$$
GSK126.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (195)
195

>  <Formula> (195)
C29H28N4O2

>  <MolWeight> (195)
464.55822

>  <Formula_> (195)
C29H28N4O2
C29H28N4O2

>  <MolWeight_> (195)
464.55822

>  <Item Name> (195)
BI-847325

>  <Catalog Number> (195)
S7843

>  <Synonyms> (195)
N/A

>  <Target> (195)
MEK

>  <Form> (195)
Free Base

>  <URL> (195)
http://www.selleckchem.com/products/bi-847325.html

>  <CAS Number> (195)
1207293-36-4

$$$$
AMI-1.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (196)
196

>  <Formula> (196)
C21H14N2Na2O9S2

>  <MolWeight> (196)
548.4534

>  <Formula_> (196)
C21H14N2Na2O9S2
C21H14N2Na2O9S2

>  <MolWeight_> (196)
548.4534

>  <Item Name> (196)
AMI-1

>  <Catalog Number> (196)
S7884

>  <Synonyms> (196)
N/A

>  <Target> (196)
Histone Methyltransferase

>  <Form> (196)
disodium salt

>  <URL> (196)
http://www.selleckchem.com/products/ami-1.html

>  <CAS Number> (196)
20324-87-2

$$$$
G007-LK.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (197)
197

>  <Formula> (197)
C25H16ClN7O3S

>  <MolWeight> (197)
529.95764

>  <Formula_> (197)
C25H16ClN7O3S
C25H16ClN7O3S

>  <MolWeight_> (197)
529.95764

>  <Item Name> (197)
G007-LK

>  <Catalog Number> (197)
S7239

>  <Synonyms> (197)
N/A

>  <Target> (197)
PARP

>  <Form> (197)
Free Base

>  <URL> (197)
http://www.selleckchem.com/products/g007-lk.html

>  <CAS Number> (197)
1380672-07-0

$$$$
GSK503.cdx
csChFnd80/10301815042D

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JAK

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1226895-15-3

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Histone Methyltransferase

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http://www.selleckchem.com/products/JNJ-26481585.html

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875320-31-3

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709002-46-0

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HIF

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Free Base

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http://www.selleckchem.com/products/kc7f2.html

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927822-86-4

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900305-37-5

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ORY-1001.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (207)
207

>  <Formula> (207)
C15H24Cl2N2

>  <MolWeight> (207)
303.27046

>  <Formula_> (207)
C15H24Cl2N2
C15H24Cl2N2

>  <MolWeight_> (207)
303.27046

>  <Item Name> (207)
ORY-1001 (RG-6016) 2HCl

>  <Catalog Number> (207)
S7795

>  <Synonyms> (207)
N/A

>  <Target> (207)
Histone Demethylase

>  <Form> (207)
Dihydrochloride

>  <URL> (207)
http://www.selleckchem.com/products/ory-1001-rg-6016.html

>  <CAS Number> (207)
1431326-61-2

$$$$
LM-3334 VX-509.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (208)
208

>  <Formula> (208)
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>  <Formula_> (208)
C18H19F3N6O
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>  <MolWeight_> (208)
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>  <Item Name> (208)
Decernotinib (VX-509)

>  <Catalog Number> (208)
S7541

>  <Synonyms> (208)
N/A

>  <Target> (208)
JAK

>  <Form> (208)
Free Base

>  <URL> (208)
http://www.selleckchem.com/products/decernotinib-vx-509.html

>  <CAS Number> (208)
944842-54-0

$$$$
Mitomycin C.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (209)
209

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C15H18N4O5

>  <MolWeight> (209)
334.32722

>  <Formula_> (209)
C15H18N4O5
C15H18N4O5

>  <MolWeight_> (209)
334.32722

>  <Item Name> (209)
Mitomycin C

>  <Catalog Number> (209)
S8146

>  <Synonyms> (209)
N/A
N/A
N/A

>  <Target> (209)
DNA/RNA Synthesis

>  <Form> (209)
Free Base

>  <URL> (209)
http://www.selleckchem.com/products/mitomycin-c.html

>  <CAS Number> (209)
50-07-7

$$$$
NVP-TNKS656.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (210)
210

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>  <Formula_> (210)
C27H34N4O5
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>  <MolWeight_> (210)
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>  <Item Name> (210)
NVP-TNKS656

>  <Catalog Number> (210)
S7238

>  <Synonyms> (210)
N/A

>  <Target> (210)
PARP

>  <Form> (210)
Free Base

>  <URL> (210)
http://www.selleckchem.com/products/nvp-tnks656.html

>  <CAS Number> (210)
1419949-20-4

$$$$
FG-2216.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (211)
211

>  <Formula> (211)
C12H9ClN2O4

>  <MolWeight> (211)
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>  <Formula_> (211)
C12H9ClN2O4
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>  <MolWeight_> (211)
280.66386

>  <Item Name> (211)
FG-2216

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S7979

>  <Synonyms> (211)
N/A

>  <Target> (211)
HIF

>  <Form> (211)
Free Base

>  <URL> (211)
http://www.selleckchem.com/products/fg-2216.html

>  <CAS Number> (211)
223387-75-5

$$$$
SGC707.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (212)
212

>  <Formula> (212)
C16H18N4O2

>  <MolWeight> (212)
298.33972

>  <Formula_> (212)
C16H18N4O2
C16H18N4O2

>  <MolWeight_> (212)
298.33972

>  <Item Name> (212)
SGC707

>  <Catalog Number> (212)
S7832

>  <Synonyms> (212)
N/A

>  <Target> (212)
Histone Methyltransferase

>  <Form> (212)
Free Base

>  <URL> (212)
http://www.selleckchem.com/products/sgc707.html

>  <CAS Number> (212)
1687736-54-4

$$$$
Molidustat(BAY 85-3934).cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (213)
213

>  <Formula> (213)
C13H14N8O2

>  <MolWeight> (213)
314.30266

>  <Formula_> (213)
C13H14N8O2
C13H14N8O2

>  <MolWeight_> (213)
314.30266

>  <Item Name> (213)
Molidustat(BAY 85-3934)

>  <Catalog Number> (213)
S8138

>  <Synonyms> (213)
N/A

>  <Target> (213)
HIF

>  <Form> (213)
Free Base

>  <URL> (213)
http://www.selleckchem.com/products/molidustat-(bay85-3934).html

>  <CAS Number> (213)
1154028-82-6

$$$$
Mirin.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (214)
214

>  <Formula> (214)
C10H8N2O2S

>  <MolWeight> (214)
220.24772

>  <Formula_> (214)
C10H8N2O2S
C10H8N2O2S

>  <MolWeight_> (214)
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>  <Item Name> (214)
Mirin

>  <Catalog Number> (214)
S8096

>  <Synonyms> (214)
N/A

>  <Target> (214)
ATM/ATR

>  <Form> (214)
Free Base

>  <URL> (214)
http://www.selleckchem.com/products/mirin.html

>  <CAS Number> (214)
1198097-97-0

$$$$
GSK2879552.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (215)
215

>  <Formula> (215)
C23H30Cl2N2O2

>  <MolWeight> (215)
437.4025

>  <Formula_> (215)
C23H30Cl2N2O2
C23H30Cl2N2O2

>  <MolWeight_> (215)
437.4025

>  <Item Name> (215)
GSK2879552 2HCl

>  <Catalog Number> (215)
S7796

>  <Synonyms> (215)
N/A

>  <Target> (215)
Histone Demethylase

>  <Form> (215)
Dihydrochloride

>  <URL> (215)
http://www.selleckchem.com/products/gsk2879552-2hcl.html

>  <CAS Number> (215)
1401966-69-5

$$$$
Daprodustat (GSK1278863).cdx
csChFnd80/10301815042D

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N/A

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HIF

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Free Base

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http://www.selleckchem.com/products/daprodustat.html

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960539-70-2

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MS023.cdx
csChFnd80/10301815042D

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MS023

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>  <Synonyms> (217)
N/A

>  <Target> (217)
Histone Methyltransferase

>  <Form> (217)
Free Base

>  <URL> (217)
http://www.selleckchem.com/products/ms023.html

>  <CAS Number> (217)
1831110-54-3

$$$$
Chaetocin.cdx
csChFnd80/10301815042D

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218

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Chaetocin

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S8068

>  <Synonyms> (218)
N/A

>  <Target> (218)
Histone Methyltransferase

>  <Form> (218)
Free Base

>  <URL> (218)
http://www.selleckchem.com/products/chaetocin.html

>  <CAS Number> (218)
28097-03-2

$$$$
AZ6102.cdx
csChFnd80/10301815042D

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AZ6102

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AZ-6102

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PPAR

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Free Base

>  <URL> (219)
http://www.selleckchem.com/products/az6102.html

>  <CAS Number> (219)
1645286-75-4

$$$$
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   11.1236    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3318    3.4927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1236    5.5854    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1236    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3318    2.0927    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
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  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
  6 10  1  0  0  0  0
 10 11  1  0  0  0  0
 12 10  1  1  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 12  1  0  0  0  0
 15 18  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
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 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  2  0  0  0  0
 27 30  2  0  0  0  0
 27 31  1  0  0  0  0
M  END
>  <Mol_ID> (220)
220

>  <Formula> (220)
C19H27N5O6S

>  <MolWeight> (220)
453.51258

>  <Formula_> (220)
C19H27N5O6S
C19H27N5O6S

>  <MolWeight_> (220)
453.51258

>  <Item Name> (220)
Oclacitinib maleate

>  <Catalog Number> (220)
S8195

>  <Synonyms> (220)
PF-03394197

>  <Target> (220)
JAK

>  <Form> (220)
Free Base

>  <URL> (220)
http://www.selleckchem.com/products/oclacitinib-maleate.html

>  <CAS Number> (220)
1640292-55-2

$$$$
PF-CBP1.cdx
csChFnd80/10301815042D

 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
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   14.3074    2.9912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6074    4.2037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2074    4.2037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1098    0.4745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6457    4.7425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7074    2.9912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4074    4.2037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8074    4.2037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5074    5.4161    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
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  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
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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
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 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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 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 18  2  0  0  0  0
 21 26  2  0  0  0  0
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 27 28  2  0  0  0  0
 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> (221)
221

>  <Formula> (221)
C29H37ClN4O3

>  <MolWeight> (221)
525.08208

>  <Formula_> (221)
C29H37ClN4O3
C29H37ClN4O3

>  <MolWeight_> (221)
525.08208

>  <Item Name> (221)
PF-CBP1 HCL

>  <Catalog Number> (221)
S8180

>  <Synonyms> (221)
N/A

>  <Target> (221)
Epigenetic Reader Domain

>  <Form> (221)
Hydrochloride

>  <URL> (221)
http://www.selleckchem.com/products/pf-cbp1.html

$$$$
GSK591 (EPZ015866, GSK3203591).cdx
csChFnd80/10301815042D

 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
    4.1395    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3520    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5644    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5644    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    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
   16.2639    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.0514    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   18.6887    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6887    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4763    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3623    2.4623    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
 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
 20 21  1  0  0  0  0
 21 16  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 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> (222)
222

>  <Formula> (222)
C22H28N4O2

>  <MolWeight> (222)
380.48332

>  <Formula_> (222)
C22H28N4O2
C22H28N4O2

>  <MolWeight_> (222)
380.48332

>  <Item Name> (222)
GSK591 (EPZ015866,GSK3203591)

>  <Catalog Number> (222)
S8111

>  <Synonyms> (222)
EPZ015866, GSK3203591

>  <Target> (222)
Histone Methyltransferase

>  <Form> (222)
Free Base

>  <URL> (222)
http://www.selleckchem.com/products/gsk591-epz015866-gsk3203591.html

>  <CAS Number> (222)
1616391-87-7

$$$$
HLCL-61.cdx
csChFnd80/10301815042D

 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
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    2.5670    5.2656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    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
    3.9387    4.9855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.7979    1.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.2822    2.4736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   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
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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
  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
 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
 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> (223)
223

>  <Formula> (223)
C23H25ClN2O

>  <MolWeight> (223)
380.9104

>  <Formula_> (223)
C23H25ClN2O
C23H25ClN2O

>  <MolWeight_> (223)
380.9104

>  <Item Name> (223)
HLCL-61 hydrochloride

>  <Catalog Number> (223)
S8209

>  <Synonyms> (223)
HLCL61

>  <Target> (223)
Histone Methyltransferase

>  <Form> (223)
Hydrochloride

>  <URL> (223)
http://www.selleckchem.com/products/hlcl-61-hydrochloride.html

>  <CAS Number> (223)
1158279-20-9

$$$$
I-BRD9 (GSK602).cdx
csChFnd80/10301815042D

 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
    3.6373    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (224)
224

>  <Formula> (224)
C22H22F3N3O3S2

>  <MolWeight> (224)
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>  <Formula_> (224)
C22H22F3N3O3S2
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>  <MolWeight_> (224)
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>  <Item Name> (224)
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S7835

>  <Synonyms> (224)
GSK602

>  <Target> (224)
Epigenetic Reader Domain

>  <Form> (224)
Free Base

>  <URL> (224)
http://www.selleckchem.com/products/i-brd9-gsk602.html

>  <CAS Number> (224)
1714146-59-4

$$$$
ETC-1002.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (225)
225

>  <Formula> (225)
C19H36O5

>  <MolWeight> (225)
344.48614

>  <Formula_> (225)
C19H36O5
C19H36O5

>  <MolWeight_> (225)
344.48614

>  <Item Name> (225)
ETC-1002

>  <Catalog Number> (225)
S7953

>  <Synonyms> (225)
Bempedoic acid|ESP-55016

>  <Target> (225)
AMPK

>  <Form> (225)
Free Base

>  <URL> (225)
http://www.selleckchem.com/products/etc-1002.html

>  <CAS Number> (225)
738606-46-7

$$$$
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csChFnd80/10301815042D

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M  END
>  <Mol_ID> (226)
226

>  <Formula> (226)
C223H330N80O51

>  <MolWeight> (226)
4947.5117

>  <Formula_> (226)
C223H330N80O51
C223H330N80O51

>  <MolWeight_> (226)
4947.5117

>  <Item Name> (226)
APTSTAT3-9R

>  <Catalog Number> (226)
S8197

>  <Synonyms> (226)
N/A

>  <Target> (226)
STAT

>  <Form> (226)
Free Base

>  <URL> (226)
http://www.selleckchem.com/products/aptstat3-9r.html

>  <CAS Number> (226)
C223H330N80O51

$$$$
BI-7273.cdx
csChFnd80/10301815042D

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227

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>  <MolWeight_> (227)
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BI-7273

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S8179

>  <Synonyms> (227)
N/A

>  <Target> (227)
Epigenetic Reader Domain

>  <Form> (227)
Free Base

>  <URL> (227)
http://www.selleckchem.com/products/bi-7273.html

>  <CAS Number> (227)
1883429-21-7

$$$$
MI-136.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (228)
228

>  <Formula> (228)
C23H21F3N6S

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>  <Formula_> (228)
C23H21F3N6S
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>  <MolWeight_> (228)
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>  <Item Name> (228)
MI-136

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S7815

>  <Synonyms> (228)
N/A

>  <Target> (228)
Androgen Receptor

>  <Form> (228)
Free Base

>  <URL> (228)
http://www.selleckchem.com/products/mi-136.html

>  <CAS Number> (228)
1628316-74-4

$$$$
A-366.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (229)
229

>  <Formula> (229)
C19H27N3O2

>  <MolWeight> (229)
329.43658

>  <Formula_> (229)
C19H27N3O2
C19H27N3O2

>  <MolWeight_> (229)
329.43658

>  <Item Name> (229)
A-366

>  <Catalog Number> (229)
S7572

>  <Synonyms> (229)
N/A

>  <Target> (229)
Histone Methyltransferase

>  <Form> (229)
Free Base

>  <URL> (229)
http://www.selleckchem.com/products/a-366.html

>  <CAS Number> (229)
1527503-11-2

$$$$
S4589 Amodiaquin (dihydrochloride dihydrate).cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (230)
230

>  <Formula> (230)
C20H28Cl3N3O3

>  <MolWeight> (230)
464.81362

>  <Formula_> (230)
C20H28Cl3N3O3
C20H28Cl3N3O3

>  <MolWeight_> (230)
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>  <Item Name> (230)
Amodiaquin (dihydrochloride dihydrate)

>  <Catalog Number> (230)
S4589

>  <Synonyms> (230)
N/A

>  <Target> (230)
Transferase,Histone

>  <Form> (230)
dihydrochloride dihydrate

>  <URL> (230)
http://www.selleckchem.com/products/amodiaquin-dihydrochloride-dihydrate.html

>  <CAS Number> (230)
6398-98-7

$$$$
MK-4827(Niraparib) tosylate.cdx
csChFnd80/10301815042D

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MK-4827(Niraparib) tosylate

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Niraparib tosylate, MK 4827 tosylate

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PARP

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4-?methylbenzen

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http://www.selleckchem.com/products/mk-4827-niraparib-tosylate.html

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1038915-73-9

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HDAC

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Free Base

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http://www.selleckchem.com/products/itsa-1-itsa1.html

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200626-61-5

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55-21-0

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Epigenetic Reader Domain

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Free Base

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http://www.selleckchem.com/products/bi-9564.html

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1883429-22-8

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236

>  <Formula> (236)
C36H42N6O

>  <MolWeight> (236)
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>  <Formula_> (236)
C36H42N6O
C36H42N6O

>  <MolWeight_> (236)
574.75828

>  <Item Name> (236)
LLY-507

>  <Catalog Number> (236)
S7575

>  <Synonyms> (236)
N/A

>  <Target> (236)
Histone Methyltransferase

>  <Form> (236)
Free Base

>  <URL> (236)
http://www.selleckchem.com/products/lly-507.html

>  <CAS Number> (236)
1793053-37-8

$$$$
S4710 Picolinamide.cdx
csChFnd80/10301815042D

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237

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C6H6N2O

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C6H6N2O
C6H6N2O

>  <MolWeight_> (237)
122.12464

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Picolinamide

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S4710

>  <Synonyms> (237)
2-Pyridinecarboxamide, Picolinoylamide, 2-Carbamoylpyridine

>  <Target> (237)
PARP

>  <Form> (237)
Free Base

>  <URL> (237)
http://www.selleckchem.com/products/picolinamide.html

>  <CAS Number> (237)
1452-77-3

$$$$
CPI-637.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (238)
238

>  <Formula> (238)
C22H22N6O

>  <MolWeight> (238)
386.44968

>  <Formula_> (238)
C22H22N6O
C22H22N6O

>  <MolWeight_> (238)
386.44968

>  <Item Name> (238)
CPI-637

>  <Catalog Number> (238)
S8190

>  <Synonyms> (238)
N/A

>  <Target> (238)
Epigenetic Reader Domain

>  <Form> (238)
Free Base

>  <URL> (238)
http://www.selleckchem.com/products/cpi-637.html

>  <CAS Number> (238)
1884712-47-3

$$$$
OICR-9429.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (239)
239

>  <Formula> (239)
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>  <Formula_> (239)
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C29H32F3N5O3

>  <MolWeight_> (239)
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>  <Item Name> (239)
OICR-9429

>  <Catalog Number> (239)
S7833

>  <Synonyms> (239)
N/A

>  <Target> (239)
Histone Methyltransferase

>  <Form> (239)
Free Base

>  <URL> (239)
http://www.selleckchem.com/products/oicr-9429.html

>  <CAS Number> (239)
1801787-56-3

$$$$
CPI-1205.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (240)
240

>  <Formula> (240)
C27H33F3N4O3

>  <MolWeight> (240)
518.5711296

>  <Formula_> (240)
C27H33F3N4O3
C27H33F3N4O3

>  <MolWeight_> (240)
518.5711296

>  <Item Name> (240)
CPI-1205

>  <Catalog Number> (240)
S8353

>  <Synonyms> (240)
CPI 1205, CPI1205

>  <Target> (240)
Histone Methyltransferase

>  <Form> (240)
Free Base

>  <URL> (240)
http://www.selleckchem.com/products/cpi-1205.html

>  <CAS Number> (240)
1621862-70-1

$$$$
BGP-15.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (241)
241

>  <Formula> (241)
C14H24Cl2N4O2

>  <MolWeight> (241)
351.27196

>  <Formula_> (241)
C14H24Cl2N4O2
C14H24Cl2N4O2

>  <MolWeight_> (241)
351.27196

>  <Item Name> (241)
BGP-15 2HCl

>  <Catalog Number> (241)
S8370

>  <Synonyms> (241)
N/A

>  <Target> (241)
PARP

>  <Form> (241)
dihydrochloride

>  <URL> (241)
http://www.selleckchem.com/products/bgp-15.html

>  <CAS Number> (241)
66611-37-8

$$$$
HPI-4 (Ciliobrevin A).cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (242)
242

>  <Formula> (242)
C17H9Cl2N3O2

>  <MolWeight> (242)
358.17826

>  <Formula_> (242)
C17H9Cl2N3O2
C17H9Cl2N3O2

>  <MolWeight_> (242)
358.17826

>  <Item Name> (242)
HPI-4 (Ciliobrevin A)

>  <Catalog Number> (242)
S8249

>  <Synonyms> (242)
Hedgehog Pathway Inhibitor 4

>  <Target> (242)
Hedgehog/Smoothened

>  <Form> (242)
Free Base

>  <URL> (242)
http://www.selleckchem.com/products/hpi-4-ciliobrevin-a.html

>  <CAS Number> (242)
302803-72-1

$$$$
CPI-455.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (243)
243

>  <Formula> (243)
C16H15ClN4O

>  <MolWeight> (243)
314.7695

>  <Formula_> (243)
C16H15ClN4O
C16H15ClN4O

>  <MolWeight_> (243)
314.7695

>  <Item Name> (243)
CPI-455 HCl

>  <Catalog Number> (243)
S8287

>  <Synonyms> (243)
N/A

>  <Target> (243)
Histone Demethylase

>  <Form> (243)
hydrochloride

>  <URL> (243)
http://www.selleckchem.com/products/cpi-455.html

>  <CAS Number> (243)
1628208-23-0(free base)

$$$$
UNC3866.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (244)
244

>  <Formula> (244)
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>  <MolWeight> (244)
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>  <Formula_> (244)
C43H66N6O8
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>  <MolWeight_> (244)
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>  <Item Name> (244)
UNC3866

>  <Catalog Number> (244)
S8359

>  <Synonyms> (244)
Free Base

>  <Target> (244)
Histone Methyltransferase

>  <Form> (244)
Free Base

>  <URL> (244)
http://www.selleckchem.com/products/unc3866.html

>  <CAS Number> (244)
1872382-47-2

$$$$
S4735 Salvianolic acid B.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (245)
245

>  <Formula> (245)
C36H30O16

>  <MolWeight> (245)
718.6138

>  <Formula_> (245)
C36H30O16
C36H30O16

>  <MolWeight_> (245)
718.6138

>  <Item Name> (245)
Salvianolic acid B

>  <Catalog Number> (245)
S4735

>  <Synonyms> (245)
Lithospermate B

>  <Target> (245)
Others

>  <Form> (245)
Free Base

>  <URL> (245)
http://www.selleckchem.com/products/salvianolic-acid-b.html

>  <CAS Number> (245)
121521-90-2

$$$$
MS049.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (246)
246

>  <Formula> (246)
C15H26Cl2N2O

>  <MolWeight> (246)
321.28574

>  <Formula_> (246)
C15H26Cl2N2O
C15H26Cl2N2O

>  <MolWeight_> (246)
321.28574

>  <Item Name> (246)
MS049

>  <Catalog Number> (246)
S8147

>  <Synonyms> (246)
N/A

>  <Target> (246)
Histone Methyltransferase

>  <Form> (246)
dihydrochloride

>  <URL> (246)
http://www.selleckchem.com/products/ms049.html

>  <CAS Number> (246)
1502816-23-0(free base)

$$$$
SRT2183.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (247)
247

>  <Formula> (247)
C27H24N4O2S

>  <MolWeight> (247)
468.57006

>  <Formula_> (247)
C27H24N4O2S
C27H24N4O2S

>  <MolWeight_> (247)
468.57006

>  <Item Name> (247)
SRT2183

>  <Catalog Number> (247)
S8270

>  <Synonyms> (247)
N/A

>  <Target> (247)
Sirtuin

>  <Form> (247)
Free Base

>  <URL> (247)
http://www.selleckchem.com/products/srt2183.html

>  <CAS Number> (247)
1001908-89-9

$$$$
UNC0638.cdx
csChFnd80/10301815042D

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>  <MolWeight_> (248)
509.72648

>  <Item Name> (248)
UNC0638

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S8071

>  <Synonyms> (248)
N/A

>  <Target> (248)
Histone Methyltransferase

>  <Form> (248)
Free Base

>  <URL> (248)
http://www.selleckchem.com/products/unc0638.html

>  <CAS Number> (248)
1255580-76-7

$$$$
EPZ020411.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (249)
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>  <Formula_> (249)
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>  <MolWeight_> (249)
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>  <Item Name> (249)
EPZ020411 2HCl

>  <Catalog Number> (249)
S7820

>  <Synonyms> (249)
N/A

>  <Target> (249)
Histone Methyltransferase

>  <Form> (249)
dihydrochloride

>  <URL> (249)
http://www.selleckchem.com/products/epz020411.html

>  <CAS Number> (249)
1700663-41-7(free base)

$$$$
MI-463.cdx
csChFnd80/10301815042D

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250

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>  <Formula_> (250)
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>  <MolWeight_> (250)
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>  <Item Name> (250)
MI-463

>  <Catalog Number> (250)
S7816

>  <Synonyms> (250)
N/A

>  <Target> (250)
Histone Methyltransferase

>  <Form> (250)
Free Base

>  <URL> (250)
http://www.selleckchem.com/products/mi-463.html

>  <CAS Number> (250)
1628317-18-9

$$$$
PNU-74654.cdx
csChFnd80/10301815042D

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Wnt/beta-catenin

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Sirtuin

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1429749-41-6

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Histone Methyltransferase

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http://www.selleckchem.com/products/mi-503.html

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1857417-13-0

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PARP

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1262417-51-5

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1910124-24-1

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>  <Mol_ID> (263)
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N/A

>  <Target> (263)
Epigenetic Reader Domain

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Free Base

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http://www.selleckchem.com/products/eed226.html

>  <CAS Number> (263)
2083627-02-3

$$$$
BIX01294 3HCl.cdx
csChFnd80/10301815042D

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BIX 01294

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>  <Synonyms> (264)
N/A

>  <Target> (264)
Histone Methyltransferase

>  <Form> (264)
trihydrochloride

>  <URL> (264)
http://www.selleckchem.com/products/bix-01294.html

>  <CAS Number> (264)
1392399-03-9

$$$$
AZD5153.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (265)
265

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C36H41N7O6

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C36H41N7O6
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AZD5153

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S8344

>  <Synonyms> (265)
N/A

>  <Target> (265)
Epigenetic Reader Domain

>  <Form> (265)
2-Naphthalenecarboxylic acid

>  <URL> (265)
http://www.selleckchem.com/products/azd5153.html

>  <CAS Number> (265)
1869912-40-2

$$$$
A-196.cdx
csChFnd80/10301815042D

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>  <Mol_ID> (266)
266

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C18H16Cl2N4

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C18H16Cl2N4

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S7983
S7983
A-196

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>  <Synonyms> (266)
N/A

>  <Target> (266)
SUV420H1,SUV420H2

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free base

>  <URL> (266)
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M  END
>  <Mol_ID> (271)
271

>  <Formula> (271)
C22H21Cl2N3O3

>  <MolWeight> (271)
446.32644

>  <Formula_> (271)
C22H21Cl2N3O3
C22H21Cl2N3O3

>  <MolWeight_> (271)
446.32644

>  <Item Name> (271)
PF-06726304

>  <Catalog Number> (271)
S8494 

>  <Synonyms> (271)
PF-6726304

>  <Target> (271)
Ezh2 (wild-type),EZH2 Y641N

>  <Form> (271)
free base

>  <URL> (271)
http://www.selleckchem.com/products/pf-06726304.html

>  <CAS Number> (271)
1616287-82-1

$$$$
CP2.cdx
csChFnd80/10301815042D

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>  <Item Name> (275)
Sodium Aescinate

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S3770

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Escin sodium salt

>  <Target> (275)
Others

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sodium salt

>  <URL> (275)
http://www.selleckchem.com/products/sodium-aescinate.html

>  <CAS Number> (275)
20977-05-3

$$$$
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HDAC1,2,6

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>  <URL> (276)
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>  <CAS Number> (276)
1206731-57-8

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SIRT6,SIRT1,SIRT2

>  <Form> (277)
free base

>  <URL> (277)
http://www.selleckchem.com/products/oss-128167.html

>  <CAS Number> (277)
887686-02-4

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free base

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499-44-5

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M  END
>  <Mol_ID> (279)
279

>  <Formula> (279)
C17H18N4O4

>  <MolWeight> (279)
342.34922

>  <Formula_> (279)
C17H18N4O4
C17H18N4O4

>  <MolWeight_> (279)
342.34922

>  <Item Name> (279)
LLY-283

>  <Catalog Number> (279)
S8479

>  <Synonyms> (279)
N/A

>  <Target> (279)
PRMT5

>  <Form> (279)
free base

>  <URL> (279)
http://www.selleckchem.com/products/lly-283.html

>  <CAS Number> (279)
2040291-27-6

$$$$
UNC0642.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (280)
280

>  <Formula> (280)
C29H44F2N6O2

>  <MolWeight> (280)
546.6954664

>  <Formula_> (280)
C29H44F2N6O2
C29H44F2N6O2

>  <MolWeight_> (280)
546.6954664

>  <Item Name> (280)
UNC0642

>  <Catalog Number> (280)
S7230

>  <Synonyms> (280)
N/A

>  <Target> (280)
G9a,GLP

>  <Form> (280)
free base

>  <URL> (280)
http://www.selleckchem.com/products/unc0642.html

>  <CAS Number> (280)
1481677-78-4

$$$$
JQ-EZ-05 (JQEZ5).cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (281)
281

>  <Formula> (281)
C30H38N8O2

>  <MolWeight> (281)
542.67512

>  <Formula_> (281)
C30H38N8O2
C30H38N8O2

>  <MolWeight_> (281)
542.67512

>  <Item Name> (281)
JQ-EZ-05 (JQEZ5)

>  <Catalog Number> (281)
S8607

>  <Synonyms> (281)
N/A

>  <Target> (281)
EZH1,EZH2

>  <Form> (281)
free base

>  <URL> (281)
http://www.selleckchem.com/products/jq-ez-05-jqez5.html

>  <CAS Number> (281)
1913252-04-6

$$$$
Sodium valproate.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (282)
282

>  <Formula> (282)
C8H15NaO2

>  <MolWeight> (282)
166.19327

>  <Formula_> (282)
C8H15NaO2
C8H15NaO2

>  <MolWeight_> (282)
166.19327

>  <Item Name> (282)
Valproic acid sodium salt (Sodium valproate)

>  <Catalog Number> (282)
S1168

>  <Synonyms> (282)
N/A 

>  <Target> (282)
GABA Receptor, HDAC

>  <URL> (282)
http://www.selleckchem.com/products/Sodium-valproate.html

>  <CAS Number> (282)
1069-66-5, 99-66-1 (FREE BASE)

$$$$
S5438 Biphenyl-4-sulfonyl chloride.cdx
csChFnd80/10301815042D

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M  END
>  <Mol_ID> (283)
283

>  <Formula> (283)
C12H9ClO2S

>  <MolWeight> (283)
252.71666

>  <Formula_> (283)
C12H9ClO2S
C12H9ClO2S

>  <MolWeight_> (283)
252.71666

>  <Item Name> (283)
Biphenyl-4-sulfonyl chloride

>  <Catalog Number> (283)
S5438

>  <Synonyms> (283)
p-Phenylbenzenesulfonyl chloride, 4-Phenylbenzenesulfonyl chloride, p-Biphenylsulfonyl chloride

>  <Target> (283)
HDAC

>  <Form> (283)
free base

>  <URL> (283)
http://selleckchem.com/products/biphenyl-4-sulfonyl-chloride.html

>  <CAS Number> (283)
1623-93-4

$$$$
S5445 AMI-1, free acid.cdx
csChFnd80/10301815042D

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    6.0559    1.2150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  4  1  0  0  0  0
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  8 13  1  0  0  0  0
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 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
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 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
 24 25  1  0  0  0  0
 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> (284)
284

>  <Formula> (284)
C21H16N2O9S2

>  <MolWeight> (284)
504.48974

>  <Formula_> (284)
C21H16N2O9S2
C21H16N2O9S2

>  <MolWeight_> (284)
504.48974

>  <Item Name> (284)
AMI-1, free acid

>  <Catalog Number> (284)
S5445

>  <Synonyms> (284)
N/A

>  <Target> (284)
Histone Methyltransferase

>  <Form> (284)
free base

>  <URL> (284)
http://selleckchem.com/products/ami-1-free-acid.html

>  <CAS Number> (284)
134-47-4

$$$$
S3934 Acetyl Resveratrol.cdx
csChFnd80/10301815042D

 26 27  0  0  0  0  0  0  0  0999 V2000
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  5  8  1  0  0  0  0
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  6 10  1  0  0  0  0
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M  END
>  <Mol_ID> (285)
285

>  <Formula> (285)
C20H18O6

>  <MolWeight> (285)
354.35332

>  <Formula_> (285)
C20H18O6
C20H18O6

>  <MolWeight_> (285)
354.35332

>  <Item Name> (285)
Acetyl Resveratrol

>  <Catalog Number> (285)
S3934

>  <Synonyms> (285)
N/A

>  <Target> (285)
Sirt12

>  <Form> (285)
free base

>  <URL> (285)
http://selleckchem.com/products/.html

>  <CAS Number> (285)
42206-94-0

$$$$
SNS-314 Mesylate.cdx
csChFnd80/10301815042D

 33 35  0  0  0  0  0  0  0  0999 V2000
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   10.7283    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 17 13  2  0  0  0  0
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 29 30  1  0  0  0  0
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 30 32  2  0  0  0  0
 30 33  1  0  0  0  0
M  END
>  <Mol_ID> (286)
287

>  <Formula> (286)
C19H19ClN6O4S3

>  <MolWeight> (286)
527.03996

>  <Formula_> (286)
C19H19ClN6O4S3
C19H19ClN6O4S3

>  <MolWeight_> (286)
527.03996

>  <Item Name> (286)
SNS-314 Mesylate

>  <Catalog Number> (286)
S1154

>  <Synonyms> (286)
N/A

>  <Target> (286)
Aurora Kinase

>  <Form> (286)
Mesylate

>  <URL> (286)
http://www.selleckchem.com/products/SNS-314.html

>  <CAS Number> (286)
1146618-41-8

$$$$
S5593 5-Carboxy-8-hydroxyquinoline.cdx
csChFnd80/10301815042D

 14 15  0  0  0  0  0  0  0  0999 V2000
    4.8500    2.0956    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  2  0  0  0  0
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  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
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 10  5  1  0  0  0  0
 10 11  1  0  0  0  0
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M  END
>  <Mol_ID> (287)
288

>  <Formula> (287)
C10H7NO3

>  <MolWeight> (287)
189.16748

>  <Formula_> (287)
C10H7NO3
C10H7NO3

>  <MolWeight_> (287)
189.16748

>  <Item Name> (287)
5-Carboxy-8-hydroxyquinoline

>  <Catalog Number> (287)
S5593

>  <Target> (287)
KDM6B

>  <Form> (287)
free base

>  <URL> (287)
http://selleckchem.com/products/.html

>  <CAS Number> (287)
5852-78-8

$$$$
Tubastatin A hydrochloride.cdx
csChFnd80/10301815042D

 25 28  0  0  0  0  0  0  0  0999 V2000
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   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
 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> (288)
289

>  <Formula> (288)
C20H21N3O2

>  <MolWeight> (288)
335.39964

>  <Formula_> (288)
C20H21N3O2
C20H21N3O2
C20H21N3

>  <MolWeight_> (288)
335.39964

>  <Item Name> (288)
Tubastatin A

>  <Catalog Number> (288)
S8049

>  <Target> (288)
others

>  <URL> (288)
https://www.selleckchem.com/products/tubastatin-a.html

>  <CAS Number> (288)
1252003-15-8

$$$$
