untitled.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (1)
2

>  <Formula> (1)
C21H18FN5O

>  <MolWeight> (1)
375.3989232

>  <Cat> (1)
S1003

>  <Name> (1)
Linifanib (ABT-869)

>  <Synonyms> (1)
AL-39324

>  <Target> (1)
PDGFR, VEGFR

>  <Form> (1)
Free Base

>  <CAS> (1)
796967-16-3

>  <URL> (1)
http://www.selleckchem.com/products/ABT-869.html

$$$$
untitled.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (2)
4

>  <Formula> (2)
C22H18N4OS

>  <MolWeight> (2)
386.46952

>  <Cat> (2)
S1005

>  <Name> (2)
Axitinib

>  <Synonyms> (2)
AG 013736

>  <Target> (2)
VEGFR, PDGFR, c-Kit

>  <Form> (2)
Free Base

>  <CAS> (2)
319460-85-0

>  <URL> (2)
http://www.selleckchem.com/products/Axitinib.html

$$$$
untitled.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (3)
5

>  <Formula> (3)
C27H32ClN5O5

>  <MolWeight> (3)
542.02648

>  <Cat> (3)
S1006

>  <Name> (3)
Saracatinib (AZD0530)

>  <Synonyms> (3)
N/A 

>  <Target> (3)
Src, Bcr-Abl

>  <Form> (3)
Free Base

>  <CAS> (3)
379231-04-6

>  <URL> (3)
http://www.selleckchem.com/products/AZD0530.html

$$$$
azd6244.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (4)
6

>  <Formula> (4)
C17H15BrClFN4O3

>  <MolWeight> (4)
457.6814032

>  <Cat> (4)
S1008

>  <Name> (4)
AZD6244 (Selumetinib)

>  <Synonyms> (4)
ARRY-142886 

>  <Target> (4)
MEK

>  <Form> (4)
Free Base

>  <CAS> (4)
606143-52-6

>  <URL> (4)
http://www.selleckchem.com/products/AZD6244.html

$$$$
untitled.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (5)
7

>  <Formula> (5)
C31H33N5O4

>  <MolWeight> (5)
539.62482

>  <Cat> (5)
S1010

>  <Name> (5)
Nintedanib (BIBF 1120)

>  <Synonyms> (5)
N/A 

>  <Target> (5)
VEGFR, PDGFR, FGFR

>  <Form> (5)
Free Base

>  <CAS> (5)
656247-17-5

>  <URL> (5)
http://www.selleckchem.com/products/BIBF1120.html

$$$$
untitled.cdx
csChFnd80/06042111292D

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 10  5  1  0  0  0  0
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M  END
>  <Mol_ID> (6)
10

>  <Formula> (6)
C25H27FN4O3

>  <MolWeight> (6)
450.5052832

>  <Cat> (6)
S1017

>  <Name> (6)
Cediranib (AZD2171)

>  <Synonyms> (6)
Recentin 

>  <Target> (6)
VEGFR, Flt

>  <Form> (6)
Free Base

>  <CAS> (6)
288383-20-0

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

$$$$
CI1040.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (7)
11

>  <Formula> (7)
C17H14ClF2IN2O2

>  <MolWeight> (7)
478.6595364

>  <Cat> (7)
S1020

>  <Name> (7)
CI-1040 (PD184352)

>  <Synonyms> (7)
N/A 

>  <Target> (7)
MEK 

>  <Form> (7)
Free Base

>  <CAS> (7)
212631-79-3

>  <URL> (7)
http://www.selleckchem.com/products/CI-1040-(PD184352).html

$$$$
Dasatinib.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (8)
12

>  <Formula> (8)
C22H26ClN7O2S

>  <MolWeight> (8)
488.00554

>  <Cat> (8)
S1021

>  <Name> (8)
Dasatinib

>  <Synonyms> (8)
BMS-354825

>  <Target> (8)
Src, Bcr-Abl, c-Kit

>  <Form> (8)
Free Base

>  <CAS> (8)
302962-49-8

>  <URL> (8)
http://www.selleckchem.com/products/Dasatinib.html

$$$$

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N/A

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c-Kit, FGFR, Flt, VEGFR, PDGFR 

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Free base

>  <CAS> (9)
405169-16-6

>  <URL> (9)
http://www.selleckchem.com/products/CHIR-258.html

$$$$
untitled.cdx
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>  <Mol_ID> (10)
15

>  <Formula> (10)
C22H24ClFN4O3

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>  <Cat> (10)
S1025

>  <Name> (10)
Gefitinib (ZD1839)

>  <Synonyms> (10)
N/A

>  <Target> (10)
EGFR

>  <Form> (10)
Free Base

>  <CAS> (10)
184475-35-2

>  <URL> (10)
http://www.selleckchem.com/products/Gefitinib.html

$$$$
Imatinib Mesylate.cdx
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>  <Mol_ID> (11)
16

>  <Formula> (11)
C30H35N7O4S

>  <MolWeight> (11)
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>  <Cat> (11)
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>  <Name> (11)
Imatinib Mesylate (STI571)

>  <Synonyms> (11)
CGP-57148B, ST-1571 Mesylate

>  <Target> (11)
PDGFR, c-Kit, Bcr-Abl

>  <Form> (11)
Mesylate

>  <CAS> (11)
220127-57-1

>  <URL> (11)
http://www.selleckchem.com/products/Imatinib-Mesylate.html

$$$$
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M  END
>  <Mol_ID> (12)
17

>  <Formula> (12)
C43H42ClFN4O10S3

>  <MolWeight> (12)
925.4607832

>  <Cat> (12)
S1028

>  <Name> (12)
Lapatinib (GW-572016) Ditosylate

>  <Synonyms> (12)
GW-57201

>  <Target> (12)
EGFR, HER2

>  <Form> (12)
Ditosylat

>  <CAS> (12)
388082-77-7

>  <URL> (12)
http://www.selleckchem.com/products/Lapatinib-Ditosylate.html

$$$$
untitled.cdx
csChFnd80/06042111292D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (13)
18

>  <Formula> (13)
C13H13N3O3

>  <MolWeight> (13)
259.26062

>  <Cat> (13)
S1029

>  <Name> (13)
Lenalidomide (CC-5013)

>  <Synonyms> (13)
CC-5013

>  <Target> (13)
TNF-alpha

>  <Form> (13)
Free Base

>  <CAS> (13)
191732-72-6

>  <URL> (13)
http://www.selleckchem.com/products/Lenalidomide.html

$$$$
Motesanib Diphosphate(AMG-706).cdx
csChFnd80/06042111292D

 38 39  0  0  0  0  0  0  0  0999 V2000
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    1.2124    9.3722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 14  9  1  0  0  0  0
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M  END
>  <Mol_ID> (14)
20

>  <Formula> (14)
C22H29N5O9P2

>  <MolWeight> (14)
569.441282

>  <Cat> (14)
S1032

>  <Name> (14)
Motesanib Diphosphate (AMG-706)

>  <Synonyms> (14)
AMG-706

>  <Target> (14)
VEGFR, PDGFR, c-Kit

>  <Form> (14)
Diphosphate

>  <CAS> (14)
857876-30-3

>  <URL> (14)
http://www.selleckchem.com/products/Motesanib-Diphosphate.html

$$$$
untitled.cdx
csChFnd80/06042111292D

 39 43  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (15)
21

>  <Formula> (15)
C28H22F3N7O

>  <MolWeight> (15)
529.5157896

>  <Cat> (15)
S1033

>  <Name> (15)
Nilotinib (AMN-107)

>  <Synonyms> (15)
Tasigna 

>  <Target> (15)
Bcr-Abl

>  <Form> (15)
Free Base

>  <CAS> (15)
641571-10-0

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

$$$$
untitled.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (16)
22

>  <Formula> (16)
C21H24ClN7O2S

>  <MolWeight> (16)
473.97896

>  <Cat> (16)
S1035

>  <Name> (16)
Pazopanib HCl

>  <Synonyms> (16)
GW786034

>  <Target> (16)
VEGFR, PDGFR, c-Kit

>  <Form> (16)
Hydrochloride

>  <CAS> (16)
635702-64-6

>  <URL> (16)
http://www.selleckchem.com/products/Pazopanib-Hydrochloride.html

$$$$
untitled.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (17)
23

>  <Formula> (17)
C16H14F3IN2O4

>  <MolWeight> (17)
482.1930396

>  <Cat> (17)
S1036

>  <Name> (17)
PD0325901

>  <Synonyms> (17)
N/A

>  <Target> (17)
MEK 

>  <Form> (17)
Free Base

>  <CAS> (17)
391210-10-9

>  <URL> (17)
http://www.selleckchem.com/products/PD-0325901.html

$$$$
1.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (18)
26

>  <Formula> (18)
C19H16N4O3

>  <MolWeight> (18)
348.35534

>  <Cat> (18)
S1038

>  <Name> (18)
PI-103

>  <Synonyms> (18)
N/A

>  <Target> (18)
DNA-PK, PI3K, mTOR

>  <Form> (18)
Free Base

>  <CAS> (18)
371935-74-9

>  <URL> (18)
http://www.selleckchem.com/products/PI-103.html

$$$$

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M  END
>  <Mol_ID> (19)
28

>  <Formula> (19)
C28H24ClF3N4O6S

>  <MolWeight> (19)
637.0265696

>  <Cat> (19)
S1040

>  <Name> (19)
Sorafenib Tosylate

>  <Synonyms> (19)
Bay 43-9006 

>  <Target> (19)
VEGFR, PDGFR, Raf

>  <Form> (19)
Tosylate

>  <CAS> (19)
475207-59-1

>  <URL> (19)
http://www.selleckchem.com/products/Sorafenib-Tosylate.html

$$$$

csChFnd80/06042111292D

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>  <Mol_ID> (20)
30

>  <Formula> (20)
C26H33FN4O7

>  <MolWeight> (20)
532.5612232

>  <Cat> (20)
S1042

>  <Name> (20)
Sunitinib Malate

>  <Synonyms> (20)
N/A

>  <Target> (20)
VEGFR, PDGFR, c-Kit, Flt

>  <Form> (20)
Malate

>  <CAS> (20)
341031-54-7

>  <URL> (20)
http://www.selleckchem.com/products/Sunitinib-Malate-(Sutent).html

$$$$
untitled.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (21)
32

>  <Formula> (21)
C23H28N8OS

>  <MolWeight> (21)
464.58642

>  <Cat> (21)
S1048

>  <Name> (21)
VX-680 (MK-0457, Tozasertib)

>  <Synonyms> (21)
N/A 

>  <Target> (21)
Aurora Kinase

>  <Form> (21)
Free Base

>  <CAS> (21)
639089-54-6

>  <URL> (21)
http://www.selleckchem.com/products/VX-680(MK-0457).html

$$$$
untitled.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (22)
40

>  <Formula> (22)
C28H30N6OS

>  <MolWeight> (22)
498.6424

>  <Cat> (22)
S1064

>  <Name> (22)
Masitinib (AB1010)

>  <Synonyms> (22)
N/A 

>  <Target> (22)
c-Kit, PDGFR, FGFR, FAK

>  <Form> (22)
Free Base

>  <CAS> (22)
790299-79-5

>  <URL> (22)
http://www.selleckchem.com/products/Masitinib-(AB1010).html

$$$$
untitled.cdx
csChFnd80/06042111292D

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TGF-beta/Smad

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Free Base

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301836-41-9

>  <URL> (23)
http://www.selleckchem.com/products/SB-431542.html

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>  <Mol_ID> (24)
43

>  <Formula> (24)
C26H31N3O5

>  <MolWeight> (24)
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S1069

>  <Name> (24)
Luminespib (AUY-922, NVP-AUY922)

>  <Synonyms> (24)
VER-52296

>  <Target> (24)
HSP

>  <Form> (24)
Free Base

>  <CAS> (24)
747412-49-3

>  <URL> (24)
http://www.selleckchem.com/products/NVP-AUY922.html

$$$$
untitled.cdx
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>  <Mol_ID> (25)
49

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C28H30ClN5O4S

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568.0869

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S1080

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SU11274

>  <Synonyms> (25)
PKI-SU11274

>  <Target> (25)
c-Met 

>  <Form> (25)
Free Base

>  <CAS> (25)
658084-23-2

>  <URL> (25)
http://www.selleckchem.com/products/SU11274.html

$$$$
Brivanib.cdx
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>  <Mol_ID> (26)
51

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C19H19FN4O3

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>  <Name> (26)
Brivanib (BMS-540215)

>  <Synonyms> (26)
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>  <Target> (26)
VEGFR, FGFR

>  <Form> (26)
Free Base

>  <CAS> (26)
649735-46-6

>  <URL> (26)
http://www.selleckchem.com/products/Brivanib.html

$$$$
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587871-26-9

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1089283-49-7

>  <URL> (29)
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58

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C19H16N8O

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372.38334

>  <Cat> (30)
S1094

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PF-04217903

>  <Synonyms> (30)
N/A

>  <Target> (30)
c-Met 

>  <Form> (30)
Free Base

>  <CAS> (30)
956905-27-4

>  <URL> (30)
http://www.selleckchem.com/products/PF-04217903.html

$$$$
untitled.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (31)
62

>  <Formula> (31)
C20H17Cl3N4

>  <MolWeight> (31)
419.73478

>  <Cat> (31)
S1101

>  <Name> (31)
Vatalanib (PTK787) 2HCl

>  <Synonyms> (31)
ZK 222584 (cpg-79787) 2HCl

>  <Target> (31)
VEGFR, c-Kit, Flt

>  <Form> (31)
Dihydrochloride

>  <CAS> (31)
212141-51-0

>  <URL> (31)
http://www.selleckchem.com/products/Vatalanib,Dihydrochloride-Salt.html

$$$$
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csChFnd80/06042111292D

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>  <Mol_ID> (32)
65

>  <Formula> (32)
C19H18N4O2

>  <MolWeight> (32)
334.37182

>  <Cat> (32)
S1104

>  <Name> (32)
GDC-0879

>  <Synonyms> (32)
N/A

>  <Target> (32)
Raf

>  <Form> (32)
Free Base

>  <CAS> (32)
905281-76-7

>  <URL> (32)
http://www.selleckchem.com/products/GDC-0879.html

$$$$
untitled.cdx
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>  <Mol_ID> (33)
69

>  <Formula> (33)
C26H30N6O3

>  <MolWeight> (33)
474.5548

>  <Cat> (33)
S1107

>  <Name> (33)
Danusertib (PHA-739358)

>  <Synonyms> (33)
N/A 

>  <Target> (33)
Aurora Kinase, FGFR, Bcr-Abl, c-RET, Src

>  <Form> (33)
Free Base

>  <CAS> (33)
827318-97-8

>  <URL> (33)
http://www.selleckchem.com/products/PHA-739358(Danusertib).html

$$$$
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Foretinib (GSK1363089, XL880)

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N/A 

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c-Met, VEGFR

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Free Base

>  <CAS> (34)
849217-64-7

>  <URL> (34)
http://www.selleckchem.com/products/XL880(GSK1363089,EXEL-2880).html

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JNJ-38877605

>  <Synonyms> (35)
N/A

>  <Target> (35)
c-Met 

>  <Form> (35)
Free Base

>  <CAS> (35)
943540-75-8

>  <URL> (35)
http://www.selleckchem.com/products/JNJ-38877605.html

$$$$
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80

>  <Formula> (36)
C28H24FN3O5

>  <MolWeight> (36)
501.5056632

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S1119

>  <Name> (36)
Cabozantinib (XL184, BMS-907351)

>  <Synonyms> (36)
N/A

>  <Target> (36)
VEGFR, c-Met, Flt, Tie-2, c-Kit

>  <Form> (36)
Free Base

>  <CAS> (36)
849217-68-1

>  <URL> (36)
http://www.selleckchem.com/products/XL184.html

$$$$
AT9283.cdx
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81

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N/A

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Bcr-Abl, JAK, Aurora Kinase

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Free Base

>  <CAS> (37)
896466-04-9

>  <URL> (37)
http://www.selleckchem.com/products/AT9283.html

$$$$

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>  <Mol_ID> (38)
85

>  <Formula> (38)
C22H24FN5O4

>  <MolWeight> (38)
441.4554632

>  <Cat> (38)
S1138

>  <Name> (38)
Brivanib alaninate (BMS-582664)

>  <Synonyms> (38)
N/A 

>  <Target> (38)
VEGFR, FGFR

>  <Form> (38)
Alaninate

>  <CAS> (38)
649735-63-7

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

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>  <Mol_ID> (39)
93

>  <Formula> (39)
C17H14ClF2N3O3S

>  <MolWeight> (39)
413.8261664

>  <Cat> (39)
S1152

>  <Name> (39)
PLX-4720

>  <Synonyms> (39)
N/A

>  <Target> (39)
Raf 

>  <Form> (39)
Free Base

>  <CAS> (39)
918505-84-7

>  <URL> (39)
http://www.selleckchem.com/products/PLX-4720.html

$$$$
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>  <Mol_ID> (40)
98

>  <Formula> (40)
C27H27N5O3

>  <MolWeight> (40)
469.53498

>  <Cat> (40)
S1167

>  <Name> (40)
CP-724714

>  <Synonyms> (40)
N/A

>  <Target> (40)
EGFR, HER2

>  <Form> (40)
Free Base

>  <CAS> (40)
537705-08-1

>  <URL> (40)
http://www.selleckchem.com/products/CP-724714.html

$$$$
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>  <Mol_ID> (41)
100

>  <Formula> (41)
C24H25ClN6O2

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>  <Cat> (41)
S1170

>  <Name> (41)
WZ3146

>  <Synonyms> (41)
N/A

>  <Target> (41)
EGFR

>  <Form> (41)
Free Base

>  <CAS> (41)
1214265-56-1

>  <URL> (41)
http://www.selleckchem.com/products/WZ3146.html

$$$$
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693228-63-6

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1213269-23-8

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167869-21-8

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M  END
>  <Mol_ID> (46)
108

>  <Formula> (46)
C24H25ClN6OS

>  <MolWeight> (46)
481.0129

>  <Cat> (46)
S1179

>  <Name> (46)
WZ8040

>  <Synonyms> (46)
N/A

>  <Target> (46)
EGFR

>  <Form> (46)
Free Base

>  <CAS> (46)
1214265-57-2

>  <URL> (46)
http://www.selleckchem.com/products/WZ8040.html

$$$$
ENMD-2076.cdx
csChFnd80/06042111292D

 28 31  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (47)
110

>  <Formula> (47)
C21H25N7

>  <MolWeight> (47)
375.4701

>  <Cat> (47)
S1181

>  <Name> (47)
ENMD-2076

>  <Synonyms> (47)
N/A 

>  <Target> (47)
Flt, Aurora Kinase, VEGFR

>  <Form> (47)
Tartaric Acid 

>  <CAS> (47)
934353-76-1

>  <URL> (47)
http://www.selleckchem.com/products/ENMD-2076.html

$$$$
Aprepitant.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (48)
116

>  <Formula> (48)
C23H21F7N4O3

>  <MolWeight> (48)
534.4266624

>  <Cat> (48)
S1189

>  <Name> (48)
Aprepitant (MK-0869)

>  <Synonyms> (48)
MK-0869, MK-869, L-754030, Emend 

>  <Target> (48)
Substance P

>  <Form> (48)
Free Base

>  <CAS> (48)
170729-80-3

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

$$$$
S119401 CUDC-101.cdx
csChFnd80/06042111292D

 32 34  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (49)
120

>  <Formula> (49)
C24H26N4O4

>  <MolWeight> (49)
434.48764

>  <Cat> (49)
S1194

>  <Name> (49)
CUDC-101

>  <Synonyms> (49)
N/A

>  <Target> (49)
HDAC, EGFR, HER2

>  <Form> (49)
Free Base

>  <CAS> (49)
1012054-59-9

>  <URL> (49)
http://www.selleckchem.com/products/CUDC-101.html

$$$$
AV-951.cdx
csChFnd80/06042111292D

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VEGFR, c-Kit, PDGFR

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>  <CAS> (50)
475108-18-0

>  <URL> (50)
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132

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C22H16F3N3O2S

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443.4415496

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S1220

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OSI-930

>  <Synonyms> (51)
N/A

>  <Target> (51)
c-Kit, VEGFR

>  <Form> (51)
Free Base

>  <CAS> (51)
728033-96-3

>  <URL> (51)
http://www.selleckchem.com/products/OSI-930.html

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144

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C23H21N5O3S

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S1244

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Amuvatinib (MP-470)

>  <Synonyms> (52)
N/A 

>  <Target> (52)
c-Met, c-Kit, PDGFR, Flt, c-RET

>  <Form> (52)
Free Base

>  <CAS> (52)
850879-09-3

>  <URL> (52)
http://www.selleckchem.com/products/MP-470.html

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145

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C12H9F3N2O2

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Leflunomide

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Arava

>  <Target> (53)
Dehydrogenase

>  <Form> (53)
Free Base

>  <CAS> (53)
75706-12-6

>  <URL> (53)
http://www.selleckchem.com/products/Leflunomide.html

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219580-11-7

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http://www.selleckchem.com/products/PD-173074.html

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Vemurafenib (PLX4032, RG7204)

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RO5185426

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Raf 

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Free Base

>  <CAS> (55)
918504-65-1

>  <URL> (55)
http://www.selleckchem.com/products/PLX-4032.html

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Genistein

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N/A

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Topoisomerase
EGFR

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Free Base

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446-72-0

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875337-44-3

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EGFR, Flt, VEGFR, HER2

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497839-62-0

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http://www.selleckchem.com/products/AEE788.html

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Ponatinib (AP24534)

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N/A 

>  <Target> (65)
Bcr-Abl, VEGFR, FGFR, PDGFR, Flt

>  <Form> (65)
Free Base

>  <CAS> (65)
943319-70-8

>  <URL> (65)
http://www.selleckchem.com/products/AP24534.html

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321

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Flt

>  <Form> (66)
Free Base

>  <CAS> (66)
950769-58-1

>  <URL> (66)
http://www.selleckchem.com/products/AC-220.html

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841290-80-0

>  <URL> (69)
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857531-00-1

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c-Met

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1025720-94-8

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C14H18ClN3O2S

>  <MolWeight> (75)
327.82962

>  <Cat> (75)
S1573

>  <Name> (75)
Fasudil HCl (HA-1077)

>  <Synonyms> (75)
AT-877 

>  <Target> (75)
ROCK

>  <Form> (75)
Hydrochloride

>  <CAS> (75)
105628-07-7

>  <URL> (75)
http://www.selleckchem.com/products/Fasudil-HCl(HA-1077).html

$$$$
BIRB 796 (Doramapimod).cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (76)
353

>  <Formula> (76)
C31H37N5O3

>  <MolWeight> (76)
527.65718

>  <Cat> (76)
S1574

>  <Name> (76)
BIRB 796 (Doramapimod)

>  <Synonyms> (76)
N/A

>  <Target> (76)
p38 MAPK

>  <Form> (76)
Free Base

>  <CAS> (76)
285983-48-4

>  <URL> (76)
http://www.selleckchem.com/products/BIRB-796-(Doramapimod).html

$$$$
Tie 2k inase inhibitor.cdx
csChFnd80/06042111292D

 32 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (77)
354

>  <Formula> (77)
C26H21N3O2S

>  <MolWeight> (77)
439.52884

>  <Cat> (77)
S1577

>  <Name> (77)
Tie2 kinase inhibitor

>  <Synonyms> (77)
N/A

>  <Target> (77)
Tie-2

>  <Form> (77)
Free Base

>  <CAS> (77)
948557-43-5

>  <URL> (77)
http://www.selleckchem.com/products/Tie2-kinase-inhibitor.html

$$$$

csChFnd80/06042111292D

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M  END
>  <Mol_ID> (78)
360

>  <Formula> (78)
C27H30Cl2F2N6O

>  <MolWeight> (78)
563.4695064

>  <Cat> (78)
S2686

>  <Name> (78)
NVP-BSK805 2HCl

>  <Synonyms> (78)
N/A

>  <Target> (78)
JAK

>  <Form> (78)
HCl

>  <CAS> (78)
1092499-93-8 (free base)

>  <URL> (78)
http://www.selleckchem.com/products/nvp-bsk805.html

$$$$
DCC-2036.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (79)
427

>  <Formula> (79)
C30H28FN7O3

>  <MolWeight> (79)
553.5868232

>  <Cat> (79)
S2634

>  <Name> (79)
DCC-2036 (Rebastinib)

>  <Synonyms> (79)
N/A 

>  <Target> (79)
Bcr-Abl

>  <Form> (79)
Free Base

>  <CAS> (79)
1020172-07-9

>  <URL> (79)
http://www.selleckchem.com/products/dcc-2036.html

$$$$
Biochanin A.cdx
csChFnd80/06042111292D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (80)
519

>  <Formula> (80)
C16H12O5

>  <MolWeight> (80)
284.26348

>  <Cat> (80)
S2377

>  <Name> (80)
Biochanin A (4-Methylgenistein)

>  <Synonyms> (80)
4-Methylgenistein

>  <Target> (80)
FAAH

>  <Form> (80)
Free Base

>  <CAS> (80)
491-80-5

>  <URL> (80)
http://www.selleckchem.com/products/Biochanin-A(4-Methylgenistein).html

$$$$
AMG 458.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (81)
542

>  <Formula> (81)
C30H29N5O5

>  <MolWeight> (81)
539.58176

>  <Cat> (81)
S2747

>  <Name> (81)
AMG458

>  <Synonyms> (81)
N/A

>  <Target> (81)
c-Met

>  <Form> (81)
Free Base

>  <CAS> (81)
913376-83-7 

>  <URL> (81)
http://www.selleckchem.com/products/amg458.html

$$$$
Arry-380.cdx
csChFnd80/06042111292D

 41 46  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (82)
544

>  <Formula> (82)
C29H27N7O4S

>  <MolWeight> (82)
569.63418

>  <Cat> (82)
S2752

>  <Name> (82)
HER2 Inhibitor 1

>  <Synonyms> (82)
N/A

>  <Target> (82)
HER2, EGFR

>  <Form> (82)
Free Base

>  <CAS> (82)
937265-83-3

>  <URL> (82)
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M  END
>  <Mol_ID> (86)
564

>  <Formula> (86)
C23H26IN7O2S

>  <MolWeight> (86)
591.46771

>  <Cat> (86)
S1274

>  <Name> (86)
BX-795

>  <Synonyms> (86)
N/A

>  <Target> (86)
PDK-1, IKK

>  <Form> (86)
Free Base

>  <CAS> (86)
702675-74-9

>  <URL> (86)
http://www.selleckchem.com/products/bx-795.html

$$$$
NVP-BVU972.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (87)
567

>  <Formula> (87)
C20H16N6

>  <MolWeight> (87)
340.38124

>  <Cat> (87)
S2761

>  <Name> (87)
NVP-BVU972

>  <Synonyms> (87)
N/A

>  <Target> (87)
c-Met

>  <Form> (87)
Free Base

>  <CAS> (87)
1185763-69-2

>  <URL> (87)
http://www.selleckchem.com/products/nvp-bvu972.html

$$$$

csChFnd80/06042111292D

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>  <Mol_ID> (88)
574

>  <Formula> (88)
C27H33FN6O7

>  <MolWeight> (88)
572.5853232

>  <Cat> (88)
S2769

>  <Name> (88)
Dovitinib Dilactic acid (TKI258 Dilactic aci

>  <Synonyms> (88)
CHIR-258 Dilactic acid 

>  <Target> (88)
Flt, FGFR, PDGFR, VEGFR, c-Kit

>  <Form> (88)
Dilactic Acid 

>  <CAS> (88)
852433-84-2

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

$$$$
AST-1306.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (89)
575

>  <Formula> (89)
C31H26ClFN4O5S

>  <MolWeight> (89)
621.0783432

>  <Cat> (89)
S2185

>  <Name> (89)
AST-1306

>  <Synonyms> (89)
N/A

>  <Target> (89)
EGFR

>  <Form> (89)
Mesylate

>  <CAS> (89)
1050500-29-2

>  <URL> (89)
http://www.selleckchem.com/products/ast-1306.html

$$$$
SB505124.cdx
csChFnd80/06042111292D

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>  <Name> (90)
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>  <Synonyms> (90)
N/A 

>  <Target> (90)
TGF-beta/Smad 

>  <Form> (90)
Free Base

>  <CAS> (90)
694433-59-5

>  <URL> (90)
http://www.selleckchem.com/products/sb-505124.html

$$$$
MK-2461.cdx
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>  <Mol_ID> (91)
579

>  <Formula> (91)
C24H25N5O5S

>  <MolWeight> (91)
495.5508

>  <Cat> (91)
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>  <Name> (91)
MK-2461

>  <Synonyms> (91)
N/A 

>  <Target> (91)
c-Met, FGFR, PDGFR

>  <Form> (91)
Free Base

>  <CAS> (91)
917879-39-1

>  <URL> (91)
http://www.selleckchem.com/products/mk-2461.html

$$$$
Nocodazole.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (92)
580

>  <Formula> (92)
C14H11N3O3S

>  <MolWeight> (92)
301.32044

>  <Cat> (92)
S2775

>  <Name> (92)
Nocodazole

>  <Synonyms> (92)
N/A 

>  <Target> (92)
Microtubule Associated

>  <Form> (92)
Free Base

>  <CAS> (92)
31430-18-9

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

$$$$
TAK-285.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (93)
587

>  <Formula> (93)
C26H25ClF3N5O3

>  <MolWeight> (93)
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>  <Cat> (93)
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>  <Name> (93)
TAK-285

>  <Synonyms> (93)
N/A

>  <Target> (93)
EGFR, HER2

>  <Form> (93)
Free Base

>  <CAS> (93)
871026-44-7

>  <URL> (93)
http://www.selleckchem.com/products/tak-285.html

$$$$
Piceatannol.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (98)
620

>  <Formula> (98)
C24H26N6O2S

>  <MolWeight> (98)
462.56724

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S2806

>  <Name> (98)
CEP33779

>  <Synonyms> (98)
N/A

>  <Target> (98)
JAK

>  <Form> (98)
Free Base

>  <CAS> (98)
1257704-57-6

>  <URL> (98)
http://www.selleckchem.com/products/cep33779.html

$$$$
NVP-TAE226.cdx
csChFnd80/06042111292D

 33 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (99)
624

>  <Formula> (99)
C23H25ClN6O3

>  <MolWeight> (99)
468.936

>  <Cat> (99)
S2820

>  <Name> (99)
NVP-TAE226

>  <Synonyms> (99)
N/A 

>  <Target> (99)
FAK

>  <Form> (99)
Free Base

>  <CAS> (99)
761437-28-9

>  <URL> (99)
http://www.selleckchem.com/products/nvp-tae226.html

$$$$
Quercetin.cdx
csChFnd80/06042111292D

 22 24  0  0  0  0  0  0  0  0999 V2000
    1.2082    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (100)
625

>  <Formula> (100)
C15H10O7

>  <MolWeight> (100)
302.2357

>  <Cat> (100)
S2391

>  <Name> (100)
Quercetin (Sophoretin)

>  <Synonyms> (100)
Meletin, Quercetine

>  <Target> (100)
PI3K, PKC, Src, Sirtuin

>  <Form> (100)
Free Base

>  <CAS> (100)
117-39-5

>  <URL> (100)
http://www.selleckchem.com/products/Quercetin(Sophoretin).html

$$$$
E7080.cdx
csChFnd80/06042111292D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (101)
641

>  <Formula> (101)
C21H19ClN4O4

>  <MolWeight> (101)
426.85296

>  <Cat> (101)
S1164

>  <Name> (101)
E7080 (Lenvatinib)

>  <Synonyms> (101)
N/A

>  <Target> (101)
VEGFR

>  <Form> (101)
Free Base

>  <CAS> (101)
417716-92-8

>  <URL> (101)
http://www.selleckchem.com/products/E7080.html

$$$$
AZD8330.cdx
csChFnd80/06042111292D

 25 26  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (102)
642

>  <Formula> (102)
C16H17FIN3O4

>  <MolWeight> (102)
461.2267532

>  <Cat> (102)
S2134

>  <Name> (102)
AZD8330

>  <Synonyms> (102)
N/A 

>  <Target> (102)
MEK

>  <Form> (102)
Free Base

>  <CAS> (102)
869357-68-6

>  <URL> (102)
http://www.selleckchem.com/products/AZD8330(ARRY-424704).html

$$$$
Amitriptyline hydrochloride.cdx
csChFnd80/06042111292D

 22 23  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (103)
652

>  <Formula> (103)
C20H24ClN

>  <MolWeight> (103)
313.86426

>  <Cat> (103)
S3183

>  <Name> (103)
Amitriptyline HCl 

>  <Synonyms> (103)
N/A 

>  <Target> (103)
5-HT Receptor

>  <Form> (103)
hydrochloride

>  <CAS> (103)
549-18-8

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

$$$$
KW2449.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (104)
655

>  <Formula> (104)
C20H20N4O

>  <MolWeight> (104)
332.399

>  <Cat> (104)
S2158

>  <Name> (104)
KW 2449

>  <Synonyms> (104)
N/A

>  <Target> (104)
Flt, Bcr-Abl, Aurora Kinase

>  <Form> (104)
Free Base

>  <CAS> (104)
1000669-72-6

>  <URL> (104)
http://www.selleckchem.com/products/KW-2449.html

$$$$
raf265.cdx
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>  <Mol_ID> (105)
657

>  <Formula> (105)
C24H16F6N6O

>  <MolWeight> (105)
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>  <Cat> (105)
S2161

>  <Name> (105)
RAF265 (CHIR-265)

>  <Synonyms> (105)
N/A 

>  <Target> (105)
Raf, VEGFR

>  <Form> (105)
Free Base

>  <CAS> (105)
927880-90-8

>  <URL> (105)
http://www.selleckchem.com/products/RAF265(CHIR-265).html

$$$$
Daphnetin.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (106)
659

>  <Formula> (106)
C9H6O4

>  <MolWeight> (106)
178.14154

>  <Cat> (106)
S2554

>  <Name> (106)
Daphnetin

>  <Synonyms> (106)
N/A 

>  <Target> (106)
DNA/RNA Synthesis

>  <Form> (106)
Free Base

>  <CAS> (106)
486-35-1

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

$$$$
LY2784544.cdx
csChFnd80/06042111292D

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>  <Target> (107)
JAK 

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Free Base

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1229236-86-5

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http://www.selleckchem.com/products/LY2784544.html

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AZD8931

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EGFR, HER2

>  <Form> (108)
Free Base

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848942-61-0

>  <URL> (108)
http://www.selleckchem.com/products/AZD8931.html

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Syk, Flt

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Besylate

>  <CAS> (109)
841290-81-1

>  <URL> (109)
http://www.selleckchem.com/products/R406.html

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1025065-69-3

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>  <Mol_ID> (111)
678

>  <Formula> (111)
C23H15ClF2N4O3

>  <MolWeight> (111)
468.8400064

>  <Cat> (111)
S2201

>  <Name> (111)
BMS 794833

>  <Synonyms> (111)
BMS794833

>  <Target> (111)
c-Met, VEGFR

>  <Form> (111)
Free Base

>  <CAS> (111)
1174046-72-0

>  <URL> (111)
http://www.selleckchem.com/products/BMS-794833.html

$$$$
NVP-BHG712.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (112)
679

>  <Formula> (112)
C26H20F3N7O

>  <MolWeight> (112)
503.4785096

>  <Cat> (112)
S2202

>  <Name> (112)
NVP-BHG712

>  <Synonyms> (112)
N/A

>  <Target> (112)
VEGFR, Src, Raf, Bcr-Abl

>  <Form> (112)
Free Base

>  <CAS> (112)
940310-85-0

>  <URL> (112)
http://www.selleckchem.com/products/NVP-BHG712.html

$$$$
OSI 420.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (113)
680

>  <Formula> (113)
C21H22ClN3O4

>  <MolWeight> (113)
415.87008

>  <Cat> (113)
S2205

>  <Name> (113)
OSI-420 (Desmethyl Erlotinib)

>  <Synonyms> (113)
CP-473420 

>  <Target> (113)
EGFR

>  <Form> (113)
Hydrochloride

>  <CAS> (113)
183320-51-6

>  <URL> (113)
http://www.selleckchem.com/products/OSI-420-Desmethyl-Erlotinib,CP-473420.html

$$$$
Mubritinib.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (114)
685

>  <Formula> (114)
C25H23F3N4O2

>  <MolWeight> (114)
468.4709296

>  <Cat> (114)
S2216

>  <Name> (114)
Mubritinib (TAK 165)

>  <Synonyms> (114)
TAK 165, TAK165

>  <Target> (114)
HER2

>  <Form> (114)
Free Base

>  <CAS> (114)
366017-09-6

>  <URL> (114)
http://www.selleckchem.com/products/Mubritinib-TAK-165.html

$$$$
SB 590885.cdx
csChFnd80/06042111292D

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    4.5462    1.6018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7203    2.3643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3088    1.2474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9444    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3272    0.2190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.3984    5.0355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0340    3.7881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.1946    4.8889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5590    6.1363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1609    6.2096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5878    4.8159    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3852    5.9607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7753    5.8426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5727    6.9874    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.9628    6.8693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9799    8.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.4265    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  2  0  0  0  0
  3  6  1  0  0  0  0
  2  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
  6 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17  6  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 16  1  0  0  0  0
 18 21  2  0  0  0  0
  5 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 22  1  0  0  0  0
 25 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 21 34  1  0  0  0  0
M  END
>  <Mol_ID> (115)
689

>  <Formula> (115)
C27H27N5O2

>  <MolWeight> (115)
453.53558

>  <Cat> (115)
S2220

>  <Name> (115)
SB590885

>  <Synonyms> (115)
GSK2118436 

>  <Target> (115)
Raf

>  <Form> (115)
Free Base

>  <CAS> (115)
405554-55-4 

>  <URL> (115)
http://www.selleckchem.com/products/SB590885.html

$$$$
(-)-Epigallocatechin gallate.cdx
csChFnd80/06042111292D

 33 36  0  0  0  0  0  0  0  0999 V2000
    1.2082    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.2903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.4951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    2.0976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    5.5927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    6.2903    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8413    7.6854    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6827    6.2903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4702    8.3903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    7.6903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8951    8.3903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8951    9.7903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2578    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4702    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    1.3976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4702    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8909    1.3976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2620   10.4879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1033   10.4879    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
  2  8  1  0  0  0  0
  3  9  1  0  0  0  0
  5 10  1  0  0  0  0
 10 11  1  0  0  0  0
 12 11  1  6  0  0  0
 10 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  2  0  0  0  0
 17 18  1  0  0  0  0
 18 12  1  0  0  0  0
 16 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
 14 23  1  6  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
 25 29  1  0  0  0  0
 26 30  1  0  0  0  0
 27 31  1  0  0  0  0
 22 32  1  0  0  0  0
 20 33  1  0  0  0  0
M  END
>  <Mol_ID> (116)
690

>  <Formula> (116)
C22H18O11

>  <MolWeight> (116)
458.37172

>  <Cat> (116)
S2250

>  <Name> (116)
(-)-Epigallocatechin gallate

>  <Synonyms> (116)
EGCG

>  <Target> (116)
DNA Methyltransferase,HER2,Telomerase,EGFR

>  <Form> (116)
Free Base

>  <CAS> (116)
989-51-5

>  <URL> (116)
http://www.selleckchem.com/products/(-)-Epigallocatechin-gallate.html

$$$$
Formononetin.cdx
csChFnd80/06042111292D

 20 22  0  0  0  0  0  0  0  0999 V2000
    3.6331    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    4.8976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.8951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    0.7024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    2.1000    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
    8.4786    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8993    0.0024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1075    0.7000    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
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  2  1  0  0  0  0
  4 11  1  0  0  0  0
  7 12  2  0  0  0  0
  8 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (117)
724

>  <Formula> (117)
C16H12O4

>  <MolWeight> (117)
268.26408

>  <Cat> (117)
S2299

>  <Name> (117)
Formononetin (Formononetol)

>  <Synonyms> (117)
Biochanin B, Formononetol 

>  <Target> (117)
Others

>  <Form> (117)
Free Base

>  <CAS> (117)
485-72-3

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

$$$$
Fumalic acid.cdx
csChFnd80/06042111292D

 14 14  0  0  0  0  0  0  0  0999 V2000
    1.2082    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.8951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    4.8927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    4.8927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4660    4.1951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    6.2879    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
  3  8  1  0  0  0  0
  8  9  1  0  0  0  0
  5 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
 12 14  2  0  0  0  0
M  END
>  <Mol_ID> (118)
725

>  <Formula> (118)
C10H10O4

>  <MolWeight> (118)
194.184

>  <Cat> (118)
S2300

>  <Name> (118)
Fumalic acid (Ferulic acid)

>  <Synonyms> (118)
Ferulic acid

>  <Target> (118)
Others

>  <Form> (118)
Free Base

>  <CAS> (118)
1135-24-6

>  <URL> (118)
http://www.selleckchem.com/products/Fumalic-acid(Ferulic-acid).html

$$$$
Honokiol.cdx
csChFnd80/06042111292D

 20 21  0  0  0  0  0  0  0  0999 V2000
    2.0951    3.6289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7951    2.4165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1951    2.4165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8951    3.6289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1951    4.8413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7951    4.8413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2903    3.6289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9903    2.4165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3903    2.4165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0903    3.6289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3903    4.8413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9903    4.8413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    3.6289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2927    6.0496    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0879    1.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4879    1.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1854    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0976    1.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6976    1.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 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
  1 13  1  0  0  0  0
 12 14  1  0  0  0  0
  9 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
  2 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (119)
733

>  <Formula> (119)
C18H18O2

>  <MolWeight> (119)
266.33432

>  <Cat> (119)
S2310

>  <Name> (119)
Honokiol

>  <Synonyms> (119)
N/A

>  <Target> (119)
Akt, MEK

>  <Form> (119)
Free Base

>  <CAS> (119)
35354-74-6

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

$$$$
Myricetin.cdx
csChFnd80/06042111292D

 23 25  0  0  0  0  0  0  0  0999 V2000
    1.2082    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    4.1951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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>  <Mol_ID> (120)
745

>  <Formula> (120)
C15H10O8

>  <MolWeight> (120)
318.2351

>  <Cat> (120)
S2326

>  <Name> (120)
Myricetin (Cannabiscetin)

>  <Synonyms> (120)
Cannabiscetin, Myricetol, Myricitin

>  <Target> (120)
NULL

>  <Form> (120)
Free Base

>  <CAS> (120)
529-44-2

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

$$$$
Chrysophanic acid.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (121)
771

>  <Formula> (121)
C15H10O4

>  <MolWeight> (121)
254.2375

>  <Cat> (121)
S2406

>  <Name> (121)
Chrysophanic acid (Chrysophanol)

>  <Synonyms> (121)
Chrysophanol, NSC 37132, NSC 646567

>  <Target> (121)
EGFR, mTOR

>  <Form> (121)
Free Base

>  <CAS> (121)
481-74-3

>  <URL> (121)
http://www.selleckchem.com/products/Chrysophanic-acid-Chrysophanol.html

$$$$
Imatinib.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (122)
790

>  <Formula> (122)
C29H31N7O

>  <MolWeight> (122)
493.60274

>  <Cat> (122)
S2475

>  <Name> (122)
Imatinib (STI571) 

>  <Synonyms> (122)
STI571, Glivec

>  <Form> (122)
Free Base

>  <CAS> (122)
152459-95-5

>  <URL> (122)
http://www.selleckchem.com/products/Imatinib(STI571).html

$$$$
PCI-32765.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (123)
795

>  <Formula> (123)
C25H24N6O2

>  <MolWeight> (123)
440.49706

>  <Cat> (123)
S2680

>  <Name> (123)
PCI-32765 (Ibrutinib)

>  <Synonyms> (123)
N/A

>  <Target> (123)
Src

>  <Form> (123)
Free Base

>  <CAS> (123)
936563-96-1

>  <URL> (123)
http://www.selleckchem.com/products/pci-32765.html

$$$$
TG1012009.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (124)
797

>  <Formula> (124)
C26H35N7O2S

>  <MolWeight> (124)
509.6668

>  <Cat> (124)
S2692

>  <Name> (124)
TG101209

>  <Synonyms> (124)
N/A

>  <Target> (124)
Flt, JAK, c-RET

>  <Form> (124)
Free Base

>  <CAS> (124)
936091-14-4

>  <URL> (124)
http://www.selleckchem.com/products/tg101209.html

$$$$
Telatinib (BAY 57-9352).cdx
csChFnd80/06042111292D

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>  <Mol_ID> (125)
847

>  <Formula> (125)
C20H16ClN5O3

>  <MolWeight> (125)
409.82574

>  <Cat> (125)
S2231

>  <Name> (125)
Telatinib (BAY 57-9352)

>  <Synonyms> (125)
N/A 

>  <Target> (125)
VEGFR, PDGFR, c-Kit

>  <Form> (125)
Free Base

>  <CAS> (125)
332012-40-5

>  <URL> (125)
http://www.selleckchem.com/products/Telatinib-BAY-57-9352.html

$$$$
PP121.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (126)
858

>  <Formula> (126)
C17H17N7

>  <MolWeight> (126)
319.36378

>  <Cat> (126)
S2622

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PP-121

>  <Synonyms> (126)
N/A

>  <Target> (126)
DNA-PK, mTOR, PDGF

>  <Form> (126)
Free Base

>  <CAS> (126)
1092788-83-4

>  <URL> (126)
http://www.selleckchem.com/products/PP121.html

$$$$
TAK733.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (127)
873

>  <Formula> (127)
C17H15F2IN4O4

>  <MolWeight> (127)
504.2266764

>  <Cat> (127)
S2617

>  <Name> (127)
TAK-733

>  <Synonyms> (127)
N/A 

>  <Target> (127)
MEK

>  <Form> (127)
Free Base

>  <CAS> (127)
1035555-63-5

>  <URL> (127)
http://www.selleckchem.com/products/tak-733.html

$$$$
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csChFnd80/06042111292D

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M  END
>  <Mol_ID> (139)
946

>  <Formula> (139)
C24H25ClFN5O2

>  <MolWeight> (139)
469.9390032

>  <Cat> (139)
S2727

>  <Name> (139)
Dacomitinib (PF299804, PF-00299804)

>  <Synonyms> (139)
N/A

>  <Target> (139)
EGFR

>  <Form> (139)
Free Base

>  <CAS> (139)
1110813-31-4

>  <URL> (139)
http://www.selleckchem.com/products/pf299804.html

$$$$
CP868569.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (140)
952

>  <Formula> (140)
C26H29N5O2

>  <MolWeight> (140)
443.54076

>  <Cat> (140)
S2730

>  <Name> (140)
Crenolanib (CP-868596)

>  <Synonyms> (140)
N/A 

>  <Target> (140)
PDGFR

>  <Form> (140)
Free Base

>  <CAS> (140)
670220-88-9

>  <URL> (140)
http://www.selleckchem.com/products/crenolanib-cp-868596.html

$$$$
AG-1478.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (141)
959

>  <Formula> (141)
C16H14ClN3O2

>  <MolWeight> (141)
315.75426

>  <Cat> (141)
S2728

>  <Name> (141)
AG-1478 (Tyrphostin AG-1478)

>  <Synonyms> (141)
Tyrphostin AG-1478

>  <Target> (141)
EGFR

>  <Form> (141)
Free Base

>  <CAS> (141)
153436-53-4

>  <URL> (141)
http://www.selleckchem.com/products/ag-1478-tyrphostin-ag-1478.html

$$$$
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>  <Mol_ID> (142)
960

>  <Formula> (142)
C22H27N5O4

>  <MolWeight> (142)
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PF-04691502

>  <Synonyms> (142)
N/A

>  <Target> (142)
mTOR, PI3K, Akt

>  <Form> (142)
Free Base

>  <CAS> (142)
1013101-36-4 

>  <URL> (142)
http://www.selleckchem.com/products/pf-04691502.html

$$$$
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343787-29-1

>  <URL> (143)
http://www.selleckchem.com/products/CP-673451.html

$$$$
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>  <Mol_ID> (144)
1063

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C22H19ClN6O2S

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>  <Target> (144)
EGFR

>  <Form> (144)
Free Base

>  <CAS> (144)
845272-21-1

>  <URL> (144)
http://www.selleckchem.com/products/arry334543.html

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csChFnd80/06042111292D

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>  <Mol_ID> (145)
1077

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C15H14N2O

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N/A 

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VEGFR

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Free Base

>  <CAS> (145)
194413-58-6

>  <URL> (145)
http://www.selleckchem.com/products/semaxanib-su5416.html

$$$$
SAR131675.cdx
csChFnd80/06042111292D

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VEGFR

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Free Base

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N/A

>  <URL> (146)
http://www.selleckchem.com/products/sar131675.html

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Golvatinib (E7050) 

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c-Met, VEGFR

>  <Form> (147)
Free Base

>  <CAS> (147)
928037-13-2

>  <URL> (147)
http://www.selleckchem.com/products/golvatinib-e7050.html

$$$$
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WHI-P154

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N/A

>  <Target> (148)
JAK, EGFR

>  <Form> (148)
Free Base

>  <CAS> (148)
211555-04-3

>  <URL> (148)
http://www.selleckchem.com/products/whi-p154.html

$$$$
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>  <Mol_ID> (149)
1125

>  <Formula> (149)
C21H20F3N7O3S

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PF-562271

>  <Synonyms> (149)
N/A

>  <Form> (149)
Free Base

>  <CAS> (149)
717907-75-0

>  <URL> (149)
http://www.selleckchem.com/products/pf-562271.html

$$$$
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>  <CAS> (150)
504433-23-2

>  <URL> (150)
http://www.selleckchem.com/products/gw-441756.html

$$$$
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>  <Mol_ID> (151)
1134

>  <Formula> (151)
C22H19ClFN3O2

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>  <Cat> (151)
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>  <Name> (151)
ZM 323881 HCl

>  <Synonyms> (151)
N/A

>  <Target> (151)
VEGFR

>  <Form> (151)
Hydrochloride

>  <CAS> (151)
193000-39-4

>  <URL> (151)
http://www.selleckchem.com/products/zm-323881-hcl.html

$$$$
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869288-64-2

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http://www.selleckchem.com/products/pf-573228.html

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icotinib.cdx
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EGFR

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610798-31-7

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

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S6 Kinase

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Dihydrochloride

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130964-39-5

>  <URL> (155)
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>  <Mol_ID> (156)
1233

>  <Formula> (156)
C21H23N7O2S

>  <MolWeight> (156)
437.51802

>  <Cat> (156)
S3012

>  <Name> (156)
Pazopanib

>  <Synonyms> (156)
N/A

>  <Target> (156)
VEGFR

>  <Form> (156)
Free Base

>  <CAS> (156)
444731-52-6

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

$$$$
GNF-2.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (157)
1244

>  <Formula> (157)
C18H13F3N4O2

>  <MolWeight> (157)
374.3166296

>  <Cat> (157)
S2899

>  <Name> (157)
GNF-2

>  <Synonyms> (157)
N/A

>  <Target> (157)
Bcr-Abl

>  <Form> (157)
Free Base

>  <CAS> (157)
778270-11-4

>  <URL> (157)
http://www.selleckchem.com/products/gnf-2.html

$$$$
OSI-906.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (158)
1255

>  <Formula> (158)
C26H23N5O

>  <MolWeight> (158)
421.49372

>  <Cat> (158)
S1091

>  <Name> (158)
OSI-906 (Linsitinib)

>  <Synonyms> (158)
N/A

>  <Target> (158)
IGF-1R

>  <Form> (158)
Free Base

>  <CAS> (158)
867160-71-2

>  <URL> (158)
http://www.selleckchem.com/products/OSI-906.html

$$$$
Cabozantinib£¨XL-184) malate.cdx
csChFnd80/06042111292D

 46 49  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (159)
1259

>  <Formula> (159)
C32H30FN3O10

>  <MolWeight> (159)
635.5931032

>  <Cat> (159)
S4001

>  <Name> (159)
Cabozantinib malate

>  <Synonyms> (159)
N/A

>  <Target> (159)
VEGFR

>  <Form> (159)
Malate

>  <CAS> (159)
1140909-48-3

>  <URL> (159)
http://www.selleckchem.com/products/cabozantinib-malate.html

$$$$
sennoside B.cdx
csChFnd80/06042111292D

 62 69  0  0  0  0  0  0  0  0999 V2000
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Sennoside B

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128-57-4

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

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MDBN.cdx
csChFnd80/06042111292D

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1485-00-3

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

$$$$
Taxifolin (Dihydroquercetin).cdx
csChFnd80/06042111292D

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VEGFR

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480-18-2

>  <URL> (162)
http://www.selleckchem.com/products/Taxifolin(Dihydroquercetin).html

$$$$
Refametinib (RDEA119, Bay 86-9766) .cdx
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>  <Name> (163)
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MEK

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923032-37-5

>  <URL> (163)
http://www.selleckchem.com/products/refametinib-rdea119-bay86-9766.html

$$$$
BIBW2992 (Afatinib).cdx
csChFnd80/06042111292D

 34 37  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (164)
1527

>  <Formula> (164)
C24H25ClFN5O3

>  <MolWeight> (164)
485.9384032

>  <Cat> (164)
S1011

>  <Name> (164)
Afatinib (BIBW2992)

>  <Synonyms> (164)
N/A

>  <Target> (164)
EGFR

>  <Form> (164)
Free Base

>  <CAS> (164)
439081-18-2

>  <URL> (164)
http://www.selleckchem.com/products/BIBW2992.html

$$$$
ENMD-2076 L-(+)-Tartaric acid.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (165)
1542

>  <Formula> (165)
C25H31N7O6

>  <MolWeight> (165)
525.55694

>  <Cat> (165)
S2018

>  <Name> (165)
ENMD-2076 L-(+)-Tartaric acid

>  <Synonyms> (165)
N/A

>  <Target> (165)
FLT3

>  <Form> (165)
Free Base

>  <CAS> (165)
1291074-87-7

>  <URL> (165)
http://www.selleckchem.com/products/enmd-2076-l-tartaric-acid.html

$$$$
PF-2341066.cdx
csChFnd80/06042111292D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (166)
1549

>  <Formula> (166)
C21H22Cl2FN5O

>  <MolWeight> (166)
450.3366832

>  <Cat> (166)
S1068

>  <Name> (166)
Crizotinib (PF-02341066)

>  <Synonyms> (166)
N/A 

>  <Target> (166)
c-Met, ALK

>  <Form> (166)
Free Base

>  <CAS> (166)
877399-52-5, 877399-53-6 (acetate)

>  <URL> (166)
http://www.selleckchem.com/products/PF-2341066.html

$$$$
BMS-599626 (AC480).cdx
csChFnd80/06042111292D

 39 44  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (167)
1559

>  <Formula> (167)
C27H27FN8O3

>  <MolWeight> (167)
530.5534832

>  <Cat> (167)
S1056

>  <Name> (167)
AC480 (BMS-599626)

>  <Synonyms> (167)
N/A

>  <Target> (167)
HER2

>  <Form> (167)
Free Base

>  <CAS> (167)
714971-09-2

>  <URL> (167)
http://www.selleckchem.com/products/BMS-599626.html

$$$$
S4667 Lidocaine hydrochloride.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (168)
1688

>  <Formula> (168)
C14H23ClN2O

>  <MolWeight> (168)
270.79822

>  <Cat> (168)
S4667

>  <Name> (168)
Lidocaine hydrochloride

>  <Synonyms> (168)
	Lidocaine HCL, Lidothesin, Lignocaine hydrochloride, Xyloneural

>  <Target> (168)
Others

>  <Form> (168)
hydrochloride

>  <CAS> (168)
73-78-9

>  <URL> (168)
http://www.selleckchem.com/products/lidocaine-hydrochloride.html

$$$$
S4736 Trapidil.cdx
csChFnd80/06042111292D

 15 16  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (169)
1724

>  <Formula> (169)
C10H15N5

>  <MolWeight> (169)
205.2596

>  <Cat> (169)
S4736

>  <Name> (169)
Trapidil

>  <Synonyms> (169)
Rocornal, Trapymin, Avantrin, Trapymine

>  <Target> (169)
PDGFR

>  <Form> (169)
Free Base

>  <CAS> (169)
15421-84-8

>  <URL> (169)
http://www.selleckchem.com/products/trapidil.html

$$$$
NS-187.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (170)
1744

>  <Formula> (170)
C30H31F3N8O

>  <MolWeight> (170)
576.6153496

>  <Cat> (170)
S1369

>  <Name> (170)
Bafetinib (INNO-406)

>  <Synonyms> (170)
NS-187

>  <Target> (170)
Abl,Lyn

>  <Form> (170)
Free Base

>  <CAS> (170)
859212-16-1

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

$$$$
S3609 Berbamine (dihydrochloride).cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (171)
1747

>  <Formula> (171)
C37H42Cl2N2O6

>  <MolWeight> (171)
681.64518

>  <Cat> (171)
S3609

>  <Name> (171)
Berbamine (dihydrochloride)

>  <Synonyms> (171)
N/A

>  <Target> (171)
NF-¦ÊB,bcr/abl

>  <Form> (171)
dihydrochloride

>  <CAS> (171)
6078-17-7

>  <URL> (171)
http://www.selleckchem.com/products/berbamine-dihydrochloride.html

$$$$
S3606 Fangchinoline.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (172)
1751

>  <Formula> (172)
C37H40N2O6

>  <MolWeight> (172)
608.7233

>  <Cat> (172)
S3606

>  <Name> (172)
Fangchinoline

>  <Synonyms> (172)
N/A

>  <Target> (172)
HIV-1

>  <Form> (172)
free base

>  <CAS> (172)
33889-68-8

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

$$$$
S3611 (+)-Fangchinoline.cdx
csChFnd80/06042111292D

 47 53  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (173)
1767

>  <Formula> (173)
C37H40N2O6

>  <MolWeight> (173)
608.7233

>  <Cat> (173)
S3611

>  <Name> (173)
(+)-Fangchinoline

>  <Synonyms> (173)
(+)-Limacine, Tetrandrine B, Hanfangichin B

>  <Target> (173)
Others

>  <Form> (173)
free base

>  <CAS> (173)
436-77-1

>  <URL> (173)
http://www.selleckchem.com/products/s-s-fangchinoline.html

$$$$
S3984 Nordihydroguaiaretic acid.cdx
csChFnd80/06042111292D

 22 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (174)
1882

>  <Formula> (174)
C18H22O4

>  <MolWeight> (174)
302.36488

>  <Cat> (174)
S3984

>  <Name> (174)
Nordihydroguaiaretic acid

>  <Synonyms> (174)
N/A

>  <Target> (174)
lipoxygenase

>  <Form> (174)
free base

>  <CAS> (174)
500-38-9

>  <URL> (174)
http://www.selleckchem.com/products/nordihydroguaiaretic-acid.html

$$$$
S3817 Harmine hydrochloride.cdx
csChFnd80/06042111292D

 17 18  0  0  0  0  0  0  0  0999 V2000
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    0.0000    4.5022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7130    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  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  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5  7  1  0  0  0  0
  6 11  2  0  0  0  0
  8 12  1  0  0  0  0
  8 13  1  0  0  0  0
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 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
M  END
>  <Mol_ID> (175)
1890

>  <Formula> (175)
C13H13ClN2O

>  <MolWeight> (175)
248.70812

>  <Cat> (175)
S3817

>  <Name> (175)
Harmine hydrochloride

>  <Synonyms> (175)
telepathine hydrochloride

>  <Target> (175)
DYRK1A,MNB,DYRK1B,DYRK2

>  <Form> (175)
hydrochloride

>  <CAS> (175)
343-27-1

>  <URL> (175)
http://www.selleckchem.com/products/harmine-hydrochloride.html

$$$$
S3759 Norcantharidin.cdx
csChFnd80/06042111292D

 12 14  0  0  0  0  0  0  0  0999 V2000
    0.2182    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2081    1.4028    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.5609    1.7635    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.5640    3.1635    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.2213    1.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.8915    1.3279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7168    2.4587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4040    4.9094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3197    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  9 10  1  0  0  0  0
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 10 11  2  0  0  0  0
  8 12  2  0  0  0  0
M  END
>  <Mol_ID> (176)
1919

>  <Formula> (176)
C8H8O4

>  <MolWeight> (176)
168.14672

>  <Cat> (176)
S3759

>  <Name> (176)
Norcantharidin

>  <Synonyms> (176)
Endothall anhydride

>  <Target> (176)
c-Met,EGFR

>  <Form> (176)
free base

>  <CAS> (176)
29745-04-8

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

$$$$
S3799 Gentisic acid.cdx
csChFnd80/06042111292D

 11 11  0  0  0  0  0  0  0  0999 V2000
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    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 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  2  0  0  0  0
  7 11  1  0  0  0  0
  7 10  1  0  0  0  0
M  END
>  <Mol_ID> (177)
1989

>  <Formula> (177)
C7H6O4

>  <MolWeight> (177)
154.12014

>  <Cat> (177)
S3799

>  <Name> (177)
Gentisic acid

>  <Synonyms> (177)
 DHB; 2,5-dihydroxybenzoic acid; 5-Hydroxysalicylic acid; Gentianic acid; Carboxyhydroquinone

>  <Target> (177)
Immunology & Inflammation related

>  <Form> (177)
free base

>  <CAS> (177)
490-79-9

>  <URL> (177)
http://www.selleckchem.com/products/gentisic-acid.html

$$$$
LY2109761.cdx
csChFnd80/06042111292D

 33 38  0  0  0  0  0  0  0  0999 V2000
    4.1777    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1777    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3901    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6026    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6026    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3901    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8326    5.0180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4326    5.0180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 12  1  0  0  0  0
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 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 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
  7 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  1  0  0  0  0
 24 20  2  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 24  1  0  0  0  0
 21 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 28  1  0  0  0  0
M  END
>  <Mol_ID> (178)
2001

>  <Formula> (178)
C26H27N5O2

>  <MolWeight> (178)
441.52488

>  <Cat> (178)
S2704

>  <Name> (178)
LY2109761

>  <Synonyms> (178)
N/A

>  <Target> (178)
TGF-beta/Smad

>  <Form> (178)
Free Base

>  <CAS> (178)
700874-71-1 

>  <URL> (178)
http://www.selleckchem.com/products/ly2109761.html

$$$$
INCB28060.cdx
csChFnd80/06042111292D

 31 35  0  0  0  0  0  0  0  0999 V2000
    1.2124    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2746    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6414    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5150    2.9951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1356    5.3901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5184    5.6091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3994    4.5211    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
    3.6373    6.3000    0.0000 F   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
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  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
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  2  7  2  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
 10 11  1  0  0  0  0
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  5 15  1  0  0  0  0
  9 30  1  0  0  0  0
  3 31  1  0  0  0  0
M  END
>  <Mol_ID> (179)
2002

>  <Formula> (179)
C23H17FN6O

>  <MolWeight> (179)
412.4190832

>  <Cat> (179)
S2788

>  <Name> (179)
Capmatinib (INCB28060)

>  <Synonyms> (179)
N/A

>  <Target> (179)
c-Met 

>  <Form> (179)
Free Base

>  <CAS> (179)
1029712-80-8

>  <URL> (179)
http://www.selleckchem.com/products/incb28060.html

$$$$
LY364947.cdx
csChFnd80/06042111292D

 21 24  0  0  0  0  0  0  0  0999 V2000
    2.2347    0.6624    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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TGF-beta/Smad

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Free Base

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396129-53-6

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http://www.selleckchem.com/products/ly364947.html

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Src

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Free Base

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172889-27-9

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EGFR

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Free Base

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194423-15-9

>  <URL> (182)
https://www.selleckchem.com/products/pd168393.html

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PRT062607 (P505-15, PRT2607, BIIB057) HCl

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Syk

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>  <CAS> (183)
1370261-97-4,1370261-96-3(free base)

>  <URL> (183)
https://www.selleckchem.com/products/prt062607-p505-15-hcl.html

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PP1

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Src

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172889-26-8

>  <URL> (184)
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M  END
>  <Mol_ID> (188)
2045

>  <Formula> (188)
C31H35F3N6O7S2

>  <MolWeight> (188)
724.7708096

>  <Cat> (188)
S7194

>  <Name> (188)
GZD824 Dimesylate 

>  <Synonyms> (188)
N/A

>  <Target> (188)
Bcr-Abl

>  <Form> (188)
Mesylate

>  <CAS> (188)
1421783-64-3

>  <URL> (188)
http://www.selleckchem.com/products/gzd824.html

$$$$
untitled.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (189)
2049

>  <Formula> (189)
C24H25ClN6O

>  <MolWeight> (189)
448.9479

>  <Cat> (189)
S7106

>  <Name> (189)
AZD3463

>  <Synonyms> (189)
N/A

>  <Target> (189)
ALK

>  <Form> (189)
Free Base

>  <CAS> (189)
1356962-20-3

>  <URL> (189)
http://www.selleckchem.com/products/azd3463.html

$$$$
S3868 Harmine.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (190)
2068

>  <Formula> (190)
C13H12N2O

>  <MolWeight> (190)
212.24718

>  <Cat> (190)
S3868

>  <Name> (190)
Harmine

>  <Synonyms> (190)
telepathine

>  <Target> (190)
PPAR¦Ã,MAO-A

>  <Form> (190)
free base

>  <CAS> (190)
442-51-3

>  <URL> (190)
http://www.selleckchem.com/products/harmine.html

$$$$
untitled.cdx
csChFnd80/06042111292D

 34 37  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (191)
2289

>  <Formula> (191)
C24H25ClFN5O3

>  <MolWeight> (191)
485.9384032

>  <Cat> (191)
S1019

>  <Name> (191)
CI-1033 (Canertinib)

>  <Synonyms> (191)
PD-183805 

>  <Target> (191)
EGFR, HER2

>  <Form> (191)
Free Base

>  <CAS> (191)
267243-28-7

>  <URL> (191)
http://www.selleckchem.com/products/CI-1033(Canertinib).html

$$$$
untitled.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (192)
2291

>  <Formula> (192)
C31H42N6O4

>  <MolWeight> (192)
562.70298

>  <Cat> (192)
S1043

>  <Name> (192)
Tandutinib (MLN518)

>  <Synonyms> (192)
CT53518

>  <Target> (192)
Flt

>  <Form> (192)
Free Base

>  <CAS> (192)
387867-13-2

>  <URL> (192)
http://www.selleckchem.com/products/Tandutinib-(MLN518).html

$$$$
untitled.cdx
csChFnd80/06042111292D

 30 33  0  0  0  0  0  0  0  0999 V2000
    9.6827    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827    4.8927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8951    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1075    4.8927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1075    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8951    6.9927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4702    6.9927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    4.8927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4702    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    6.9903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    4.1951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    4.8927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    6.9903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    8.3903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    9.0903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    8.3903    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    6.9903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    9.0879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8951    2.7976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1033    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1033    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3157    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5282    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5282    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3157    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8951    0.0024    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   15.7364    0.0024    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  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  2  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 15  1  0  0  0  0
 18 21  1  0  0  0  0
  3 22  1  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
 24 29  1  0  0  0  0
 26 30  1  0  0  0  0
M  END
>  <Mol_ID> (193)
2292

>  <Formula> (193)
C22H24BrFN4O2

>  <MolWeight> (193)
475.3539632

>  <Cat> (193)
S1046

>  <Name> (193)
Vandetanib (ZD6474)

>  <Synonyms> (193)
N/A

>  <Target> (193)
VEGFR

>  <Form> (193)
Free Base

>  <CAS> (193)
443913-73-3

>  <URL> (193)
http://www.selleckchem.com/products/Vandetanib.html

$$$$
PQ 401.cdx
csChFnd80/06042111292D

 24 26  0  0  0  0  0  0  0  0999 V2000
    6.0588    4.1953    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8505    4.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8505    6.2880    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6423    4.1953    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6363    0.0002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8492    0.6976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8517    2.0984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6423    2.8002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4269    2.1019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2154    2.8036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020    2.1054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2114    0.0036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0575    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2670    4.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4794    4.1929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6919    4.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6919    6.2929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4794    6.9929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2670    6.2929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4794    8.3880    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    8.4794    2.7977    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6877    2.1002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  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
  6 15  1  0  0  0  0
  4  8  1  0  0  0  0
  1 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 16  1  0  0  0  0
 20 22  1  0  0  0  0
 17 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (194)
2322

>  <Formula> (194)
C18H16ClN3O2

>  <MolWeight> (194)
341.79154

>  <Cat> (194)
S8003

>  <Name> (194)
PQ 401

>  <Synonyms> (194)
N/A

>  <Target> (194)
IGF-1R

>  <Form> (194)
Free Base

>  <CAS> (194)
196868-63-0

>  <URL> (194)
http://www.selleckchem.com/products/pq-401.html

$$$$

csChFnd80/06042111292D

 37 40  0  0  0  0  0  0  0  0999 V2000
    8.2594    6.0622    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8594    6.0622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1594    7.2746    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1594    4.8497    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6050    5.5497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9365    5.9824    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7594    4.8497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9365    3.7171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6050    4.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9555    1.9473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1326    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3097    4.2126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.2571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8229    1.1244    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.0881    2.7702    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.7784    0.8147    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    8.9594    4.8497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3594    4.8497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0594    3.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3594    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9594    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2594    3.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4594    3.6373    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5594    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.1594    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4594    1.2124    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.1594    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5594    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2594    3.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6594    3.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3594    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6594    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2594    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7594    2.4249    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.4594    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3594    4.8497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.7594    4.8497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  5  9  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 10 14  1  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
  9 11  1  0  0  0  0
  4  7  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 17 22  2  0  0  0  0
 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 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 24 33  2  0  0  0  0
 28 33  1  0  0  0  0
 23 27  1  0  0  0  0
 34 35  1  0  0  0  0
 31 34  1  0  0  0  0
 36 37  1  0  0  0  0
 30 36  1  0  0  0  0
 19 23  1  0  0  0  0
  1 17  1  0  0  0  0
M  END
>  <Mol_ID> (195)
2325

>  <Formula> (195)
C24H22F3N5O5

>  <MolWeight> (195)
517.4571896

>  <Cat> (195)
S8015

>  <Name> (195)
CEP-32496

>  <Synonyms> (195)
N/A

>  <Target> (195)
Raf

>  <Form> (195)
Free Base

>  <CAS> (195)
1188910-76-0

>  <URL> (195)
http://www.selleckchem.com/products/cep-32496.html

$$$$
AP26113.cdx
csChFnd80/06042111292D

 36 39  0  0  0  0  0  0  0  0999 V2000
   10.9119    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    2.8000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   16.2741    4.0124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 14  1  0  0  0  0
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 15 16  2  0  0  0  0
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 10 15  1  0  0  0  0
  8  9  1  0  0  0  0
 19 20  1  0  0  0  0
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 22 26  1  0  0  0  0
  7 19  1  0  0  0  0
  4 35  1  0  0  0  0
 25 36  1  0  0  0  0
M  END
>  <Mol_ID> (196)
2329

>  <Formula> (196)
C26H34ClN6O2P

>  <MolWeight> (196)
529.013921

>  <Cat> (196)
S7000

>  <Name> (196)
AP26113

>  <Synonyms> (196)
N/A

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ALK

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301305-73-7

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>  <Mol_ID> (201)
2372

>  <Formula> (201)
C30H40ClN7O3S

>  <MolWeight> (201)
614.2017

>  <Cat> (201)
S1108

>  <Name> (201)
TAE684 (NVP-TAE684)

>  <Synonyms> (201)
N/A 

>  <Target> (201)
ALK 

>  <Form> (201)
Free Base

>  <CAS> (201)
761439-42-3

>  <URL> (201)
http://www.selleckchem.com/products/NVP-TAE684.html

$$$$
SGX-523 .cdx
csChFnd80/06042111292D

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>  <Mol_ID> (202)
2374

>  <Formula> (202)
C18H13N7S

>  <MolWeight> (202)
359.40772

>  <Cat> (202)
S1112

>  <Name> (202)
SGX-523

>  <Synonyms> (202)
N/A

>  <Target> (202)
c-Met 

>  <Form> (202)
Free Base

>  <CAS> (202)
1022150-57-7

>  <URL> (202)
http://www.selleckchem.com/products/SGX-523.html

$$$$
untitled.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (203)
2375

>  <Formula> (203)
C21H16N6O2S2

>  <MolWeight> (203)
448.52074

>  <Cat> (203)
S1118

>  <Name> (203)
XL147 analogue

>  <Synonyms> (203)
SAR245408

>  <Target> (203)
PI3K 

>  <Form> (203)
Free Base

>  <CAS> (203)
956958-53-5

>  <URL> (203)
http://www.selleckchem.com/products/XL147.html

$$$$
s1023.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (204)
2376

>  <Formula> (204)
C22H24ClN3O4

>  <MolWeight> (204)
429.89666

>  <Cat> (204)
S1023

>  <Name> (204)
Erlotinib(OSI-744)

>  <Synonyms> (204)
(CP358774, NSC 718781) HCl

>  <Target> (204)
EGFR

>  <Form> (204)
Hydrochloride

>  <CAS> (204)
183319-69-9

>  <URL> (204)
http://www.selleckchem.com/products/Erlotinib-Hydrochloride.

$$$$
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>  <Mol_ID> (205)
2421

>  <Formula> (205)
C40H56

>  <MolWeight> (205)
536.87264

>  <Cat> (205)
S1767

>  <Name> (205)
Beta Carotene

>  <Synonyms> (205)
¦Â,¦Â-Carotene, Provitamin A, Solatene, ¦Â-Carotene 

>  <Target> (205)
Others

>  <Form> (205)
Free Base

>  <CAS> (205)
7235-40-7

>  <URL> (205)
http://www.selleckchem.com/products/Beta-Carotene.html

$$$$
R 788.cdx
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>  <Mol_ID> (206)
2433

>  <Formula> (206)
C23H24FN6Na2O9P

>  <MolWeight> (206)
624.4231642

>  <Cat> (206)
S2206

>  <Name> (206)
R935788 (Fostamatinib disodium)

>  <Synonyms> (206)
N/A 

>  <Target> (206)
Syk

>  <Form> (206)
Sodium Salt

>  <CAS> (206)
1025687-58-4

>  <URL> (206)
http://www.selleckchem.com/products/R788(Fostamatinib-disodium).html

$$$$
BI-847325.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (207)
2492

>  <Formula> (207)
C29H28N4O2

>  <MolWeight> (207)
464.55822

>  <Cat> (207)
S7843

>  <Name> (207)
BI-847325

>  <Synonyms> (207)
N/A

>  <Target> (207)
MEK

>  <Form> (207)
Free Base

>  <CAS> (207)
1207293-36-4

>  <URL> (207)
http://www.selleckchem.com/products/bi-847325.html

$$$$
AZ5104.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (208)
2493

>  <Formula> (208)
C27H31N7O2

>  <MolWeight> (208)
485.58074

>  <Cat> (208)
S7298

>  <Name> (208)
AZ5104

>  <Synonyms> (208)
N/A

>  <Target> (208)
EGFR

>  <Form> (208)
Free Base

>  <CAS> (208)
1421373-98-9

>  <URL> (208)
http://www.selleckchem.com/products/az5104.html

$$$$
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M  END
>  <Mol_ID> (209)
2498

>  <Formula> (209)
C31H23F2N5O3

>  <MolWeight> (209)
551.5428264

>  <Cat> (209)
S7669

>  <Name> (209)
NPS-1034

>  <Synonyms> (209)
N/A

>  <Target> (209)
c-Met

>  <Form> (209)
Free Base

>  <CAS> (209)
1221713-92-3

>  <URL> (209)
http://www.selleckchem.com/products/nps-1034.html

$$$$
GDC0623.cdx
csChFnd80/06042111292D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (210)
2505

>  <Formula> (210)
C16H14FIN4O3

>  <MolWeight> (210)
456.2102332

>  <Cat> (210)
S7553

>  <Name> (210)
GDC-0623

>  <Synonyms> (210)
G-868

>  <Target> (210)
MEK

>  <Form> (210)
Free Base

>  <CAS> (210)
1168091-68-6

>  <URL> (210)
http://www.selleckchem.com/products/gdc-0623.html

$$$$
Dibutyryl-cAMP.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (211)
2510

>  <Formula> (211)
C18H23N5NaO8P

>  <MolWeight> (211)
491.367451

>  <Cat> (211)
S7858

>  <Name> (211)
Dibutyryl-cAMP (Bucladesine)

>  <Synonyms> (211)
dbcAMP

>  <Target> (211)
PKA

>  <Form> (211)
sodium salt

>  <CAS> (211)
16980-89-5

>  <URL> (211)
http://www.selleckchem.com/products/dibutyryl-camp-bucladesine.html

$$$$
8-Bromo-cAMP.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (212)
2514

>  <Formula> (212)
C10H10BrN5NaO6P

>  <MolWeight> (212)
430.083831

>  <Cat> (212)
S7857

>  <Name> (212)
8-Bromo-cAMP

>  <Synonyms> (212)
N/A

>  <Target> (212)
PKA

>  <Form> (212)
sodium salt

>  <CAS> (212)
76939-46-3

>  <URL> (212)
http://www.selleckchem.com/products/8-bromo-camp.html

$$$$
BLU9931.cdx
csChFnd80/06042111292D

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1538604-68-0

>  <URL> (213)
http://www.selleckchem.com/products/blu9931.html

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N/A

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TAM Receptor

>  <Form> (214)
Free Base

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1341200-45-0

>  <URL> (214)
http://www.selleckchem.com/products/tp-0903.html

$$$$
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>  <URL> (215)
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1351635-67-0

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1449685-96-4

>  <URL> (217)
http://www.selleckchem.com/products/ddr1-in-1.html

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N/A

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VEGFR

>  <Form> (218)
Free Base

>  <CAS> (218)
215543-92-3

>  <URL> (218)
http://www.selleckchem.com/products/su5402.html

$$$$
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UNC-2025

>  <Synonyms> (219)
N/A

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TAM Receptor

>  <Form> (219)
hydrochloride salt

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1429881-91-3

>  <URL> (219)
http://www.selleckchem.com/products/unc-2025.html

$$$$
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C17H15N9

>  <MolWeight> (220)
345.3613

>  <Cat> (220)
S7674

>  <Name> (220)
Savolitinib(AZD6094, HMPL-504)

>  <Synonyms> (220)
Volitinib

>  <Target> (220)
MET

>  <Form> (220)
free base

>  <CAS> (220)
1313725-88-0

>  <URL> (220)
http://www.selleckchem.com/products/hmpl-504-azd6094-volitinib.html

$$$$
MEK162 (ARRY-438162).cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (221)
2617

>  <Formula> (221)
C17H15BrF2N4O3

>  <MolWeight> (221)
441.2268064

>  <Cat> (221)
S7007

>  <Name> (221)
Binimetinib (MEK162, ARRY-162, ARRY-438162)

>  <Synonyms> (221)
N/A

>  <Target> (221)
MEK

>  <Form> (221)
Free Base

>  <CAS> (221)
606143-89-9

>  <URL> (221)
http://www.selleckchem.com/products/mek162.html

$$$$
BIO (6-bromoindirubin-3-oxime).cdx
csChFnd80/06042111292D

 22 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (222)
2624

>  <Formula> (222)
C16H10BrN3O2

>  <MolWeight> (222)
356.1735

>  <Cat> (222)
S7198

>  <Name> (222)
BIO

>  <Synonyms> (222)
GSK-3 Inhibitor IX, 6-bromoindirubin-3-oxime

>  <Target> (222)
GSK-3

>  <Form> (222)
Free Base

>  <CAS> (222)
667463-62-9

>  <URL> (222)
http://www.selleckchem.com/products/bio.html

$$$$
RepSox (E-616452, SJN 2511).cdx
csChFnd80/06042111292D

 22 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (223)
2628

>  <Formula> (223)
C17H13N5

>  <MolWeight> (223)
287.31862

>  <Cat> (223)
S7223

>  <Name> (223)
RepSox

>  <Synonyms> (223)
E-616452, SJN 2511

>  <Target> (223)
TGF-beta/Smad

>  <Form> (223)
Free Base

>  <CAS> (223)
446859-33-2

>  <URL> (223)
http://www.selleckchem.com/products/repsox.html

$$$$
ZM39923 HCl.cdx
csChFnd80/06042111292D

 26 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (224)
2633

>  <Formula> (224)
C23H26ClNO

>  <MolWeight> (224)
367.91164

>  <Cat> (224)
S8004

>  <Name> (224)
ZM 39923 HCl

>  <Synonyms> (224)
N/A

>  <Target> (224)
JAK

>  <Form> (224)
HCl

>  <CAS> (224)
1021868-92-7

>  <URL> (224)
http://www.selleckchem.com/products/zm-39923-hcl.html

$$$$
CO-1686(AVL-301).cdx
csChFnd80/06042111292D

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EGFR

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1374640-70-6

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XL019

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JAK

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C24H27N7O

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AZ191

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N/A

>  <Target> (229)
DYRK

>  <Form> (229)
Free Base

>  <URL> (229)
http://www.selleckchem.com/products/az191.html

$$$$
Pacritinib (SB1518).cdx
csChFnd80/06042111292D

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2726

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C28H32N4O3

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S8057

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Pacritinib (SB1518)

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N/A

>  <Target> (230)
JAK

>  <Form> (230)
Free Base

>  <CAS> (230)
937272-79-2

>  <URL> (230)
http://www.selleckchem.com/products/pacritinib-sb1518.html

$$$$
Sorafenib.cdx
csChFnd80/06042111292D

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C21H16ClF3N4O3

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S7397

>  <Name> (231)
Sorafenib

>  <Synonyms> (231)
BAY 43-9006

>  <Target> (231)
Raf

>  <Form> (231)
Free Base

>  <CAS> (231)
284461-73-0

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

$$$$
PF-562271.cdx
csChFnd80/06042111292D

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2731

>  <Formula> (232)
C21H21ClF3N7O3S

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>  <Cat> (232)
S7357

>  <Name> (232)
PF-562271 HCl

>  <Synonyms> (232)
N/A

>  <Target> (232)
FAK

>  <Form> (232)
Hydrochloride

>  <URL> (232)
http://www.selleckchem.com/products/pf-562271-hcl.html

$$$$
ID-8.cdx
csChFnd80/06042111292D

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TGF-beta/Smad

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1431985-92-0

>  <URL> (237)
http://www.selleckchem.com/products/k02288.html

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LDN193189 HCl.cdx
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C25H23ClN6

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LDN193189 HCl

>  <Synonyms> (238)
N/A

>  <Target> (238)
TGF-beta/Smad

>  <Form> (238)
Hydrochloride

>  <CAS> (238)
1062368-62-0

>  <URL> (238)
http://www.selleckchem.com/products/ldn-193189-HCl.html

$$$$
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C13H12N4O2S2

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SKLB1002

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VEGFR

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1225451-84-2

>  <URL> (239)
http://www.selleckchem.com/products/sklb1002.html

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ML347

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TGF-beta/Smad

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Free Base

>  <CAS> (240)
1062368-49-3

>  <URL> (240)
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1432597-26-6

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http://www.selleckchem.com/products/cgi1746.html

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M  END
>  <Mol_ID> (249)
2868

>  <Formula> (249)
C32H36N6O4

>  <MolWeight> (249)
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>  <Cat> (249)
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WH-4-023

>  <Synonyms> (249)
KIN001-112

>  <Target> (249)
Src

>  <Form> (249)
Free Base

>  <CAS> (249)
837422-57-8

>  <URL> (249)
http://www.selleckchem.com/products/wh-4-023.html

$$$$
SF1670 (PTEN inhibitor).cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (250)
2871

>  <Formula> (250)
C19H17NO3

>  <MolWeight> (250)
307.34318

>  <Cat> (250)
S7310

>  <Name> (250)
SF1670 (PTEN inhibitor)

>  <Synonyms> (250)
N/A

>  <Target> (250)
PTEN

>  <Form> (250)
Free Base

>  <CAS> (250)
345630-40-2

>  <URL> (250)
http://www.selleckchem.com/products/sf1670.html

$$$$
filgotinib.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (251)
2890

>  <Formula> (251)
C21H23N5O3S

>  <MolWeight> (251)
425.50402

>  <Cat> (251)
S7605

>  <Name> (251)
Filgotinib£¨GLPG0643)

>  <Synonyms> (251)
N/A

>  <Target> (251)
JAK

>  <Form> (251)
Free Base

>  <CAS> (251)
1206161-97-8

>  <URL> (251)
http://www.selleckchem.com/products/filgotinib.html

$$$$
GNF5837.cdx
csChFnd80/06042111292D

 39 43  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (252)
2901

>  <Formula> (252)
C28H21F4N5O2

>  <MolWeight> (252)
535.4922528

>  <Cat> (252)
S7519

>  <Name> (252)
GNF-5837

>  <Synonyms> (252)
N/A

>  <Target> (252)
Trk receptor

>  <Form> (252)
Free Base

>  <CAS> (252)
1033769-28-6

>  <URL> (252)
http://www.selleckchem.com/products/gnf-5837.html

$$$$
LY2874455.cdx
csChFnd80/06042111292D

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PI3K

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1246560-33-7

>  <URL> (257)
http://www.selleckchem.com/products/vs-5584-sb2343.html

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JAK

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Hydrochloride

>  <CAS> (258)
1369761-01-2

>  <URL> (258)
http://www.selleckchem.com/products/cerdulatinib-prt062070-prt2070.html

$$$$
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AXL1717

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IGF-1R

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Free Base

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477-47-4

>  <URL> (259)
http://www.selleckchem.com/products/picropodophyllin-ppp.html

$$$$
AT13148.cdx
csChFnd80/06042111292D

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Akt

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1056901-62-2

>  <URL> (260)
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$$$$
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717906-29-1

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http://www.selleckchem.com/products/pf-431396.html

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FAK

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1061353-68-1

>  <URL> (262)
http://www.selleckchem.com/products/pnd-1186-vs-4718.html

$$$$
Defactinib.cdx
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FAK

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1073154-85-4

>  <URL> (263)
http://www.selleckchem.com/products/defactinib.html

$$$$
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EGFR

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1092364-38-9

>  <URL> (264)
http://www.selleckchem.com/products/poziotinib-hm781-36b.html

$$$$
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915769-50-5

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953769-46-5

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FGFR

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1265229-25-1

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http://www.selleckchem.com/products/ch5183284-debio-1347.html

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3005

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Dasatinib Monohydrate

>  <Synonyms> (272)
BMS-354825 Monohydrate

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Src

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Monohydrate

>  <CAS> (272)
863127-77-9

>  <URL> (272)
http://www.selleckchem.com/products/dasatinib-monohydrate.html

$$$$
LM-3572.cdx
csChFnd80/06042111292D

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C22H27FN4O2

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398.4737832

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S7781

>  <Name> (273)
Sunitinib

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SU11248

>  <Target> (273)
PDGFR

>  <Form> (273)
Free Base

>  <CAS> (273)
557795-19-4

>  <URL> (273)
http://www.selleckchem.com/products/sunitinib.html

$$$$
Erlotinib free Base.cdx
csChFnd80/06042111292D

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3008

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C22H23N3O4

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393.43572

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Erlotinib

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CP358774, NSC 718781

>  <Target> (274)
EGFR

>  <Form> (274)
Free Base

>  <CAS> (274)
183321-74-6

>  <URL> (274)
http://www.selleckchem.com/products/erlotinib.html

$$$$
CL-387785.cdx
csChFnd80/06042111292D

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3010

>  <Formula> (275)
C18H13BrN4O

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381.22602

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CL-387785 (EKI-785)

>  <Synonyms> (275)
N/A

>  <Target> (275)
EGFR

>  <Form> (275)
Free Base

>  <CAS> (275)
194423-06-8

>  <URL> (275)
http://www.selleckchem.com/products/cl-387785-eki-785.html

$$$$
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csChFnd80/06042111292D

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>  <Mol_ID> (280)
3047

>  <Formula> (280)
C31H33FN6O3

>  <MolWeight> (280)
556.6305232

>  <Cat> (280)
S7799

>  <Name> (280)
Pexmetinib (ARRY-614)

>  <Synonyms> (280)
N/A

>  <Target> (280)
p38 MAPK

>  <Form> (280)
Free Base

>  <CAS> (280)
945614-12-0

>  <URL> (280)
http://www.selleckchem.com/products/pexmetinib-arry-614.html

$$$$
LY3009120.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (281)
3049

>  <Formula> (281)
C23H29FN6O

>  <MolWeight> (281)
424.5143632

>  <Cat> (281)
S7842

>  <Name> (281)
LY3009120

>  <Synonyms> (281)
N/A

>  <Target> (281)
Raf

>  <Form> (281)
Free Base

>  <CAS> (281)
1454682-72-4

>  <URL> (281)
http://www.selleckchem.com/products/ly3009120.html

$$$$
PLX3397.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (282)
3053

>  <Formula> (282)
C20H15ClF3N5

>  <MolWeight> (282)
417.8148096

>  <Cat> (282)
S7818

>  <Name> (282)
Pexidartinib (PLX3397)

>  <Synonyms> (282)
N/A

>  <Target> (282)
CSF-1R

>  <Form> (282)
Free Base

>  <CAS> (282)
1029044-16-3

>  <URL> (282)
http://www.selleckchem.com/products/pexidartinib-plx3397.html

$$$$
GDC-0973(XL518,RG7420.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (283)
3054

>  <Formula> (283)
C21H21F3IN3O2

>  <MolWeight> (283)
531.3100196

>  <Cat> (283)
S8041

>  <Name> (283)
Cobimetinib (GDC-0973, RG7420)

>  <Synonyms> (283)
XL518

>  <Target> (283)
MEK

>  <Form> (283)
Free Base

>  <CAS> (283)
934660-93-2

>  <URL> (283)
http://www.selleckchem.com/products/cobimetinib-gdc-0973-rg7420.html

$$$$
ASP015K.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (284)
3072

>  <Formula> (284)
C18H22N4O2

>  <MolWeight> (284)
326.39288

>  <Cat> (284)
S7650

>  <Name> (284)
Peficitinib (ASP015K, JNJ-54781532)

>  <Synonyms> (284)
N/A

>  <Target> (284)
JAK

>  <Form> (284)
Free Base

>  <CAS> (284)
944118-01-8

>  <URL> (284)
http://www.selleckchem.com/products/peficitinb-asp015k-jnj-54781532.html

$$$$
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$$$$
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M  END
>  <Mol_ID> (291)
3114

>  <Formula> (291)
C28H24F3N7O2

>  <MolWeight> (291)
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GNF-7

>  <Synonyms> (291)
N/A

>  <Target> (291)
Bcr-Abl

>  <Form> (291)
Free Base

>  <CAS> (291)
839706-07-9

>  <URL> (291)
http://www.selleckchem.com/products/gnf-7.html

$$$$
Oclacitinib maleate.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (292)
3148

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C19H27N5O6S

>  <MolWeight> (292)
453.51258

>  <Cat> (292)
S8195

>  <Name> (292)
Oclacitinib maleate

>  <Synonyms> (292)
PF-03394197

>  <Target> (292)
JAK

>  <Form> (292)
Free Base

>  <CAS> (292)
1640292-55-2

>  <URL> (292)
http://www.selleckchem.com/products/oclacitinib-maleate.html

$$$$
MLN2480.cdx
csChFnd80/06042111292D

 32 34  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (293)
3150

>  <Formula> (293)
C17H12Cl2F3N7O2S

>  <MolWeight> (293)
506.2890896

>  <Cat> (293)
S7121

>  <Name> (293)
MLN2480

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BIIB-024

>  <Target> (293)
Raf

>  <Form> (293)
Free Base

>  <CAS> (293)
1096708-71-2

>  <URL> (293)
http://www.selleckchem.com/products/mln2480.html

$$$$
Acalabrutinib.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (294)
3152

>  <Formula> (294)
C26H23N7O2

>  <MolWeight> (294)
465.50652

>  <Cat> (294)
S8116

>  <Name> (294)
Acalabrutinib (ACP-196)

>  <Synonyms> (294)
N/A

>  <Target> (294)
BTK

>  <Form> (294)
Free Base

>  <CAS> (294)
1420477-60-6

>  <URL> (294)
http://www.selleckchem.com/products/acalabrutinib.html

$$$$
PLX7904.cdx
csChFnd80/06042111292D

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Raf

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Free Base

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1393465-84-3

>  <URL> (295)
http://www.selleckchem.com/products/plx7904.html

$$$$
AMG337.cdx
csChFnd80/06042111292D

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3204

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C23H22FN7O3

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AMG 337

>  <Synonyms> (296)
N/A

>  <Target> (296)
c-Met

>  <Form> (296)
Free Base

>  <CAS> (296)
1173699-31-4

>  <URL> (296)
http://www.selleckchem.com/products/amg-337.html

$$$$
Olmutinib (HM61713, BI 1482694).cdx
csChFnd80/06042111292D

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3219

>  <Formula> (297)
C26H26N6O2S

>  <MolWeight> (297)
486.58864

>  <Cat> (297)
S8294

>  <Name> (297)
Olmutinib (HM61713, BI 1482694)

>  <Synonyms> (297)
BI 1482694, HM61713, HM71224

>  <Target> (297)
EGFR

>  <Form> (297)
Free Base

>  <CAS> (297)
1353550-13-6

>  <URL> (297)
http://www.selleckchem.com/products/olmutinib-hm61713-bi-1482694.html

$$$$
5-Iodotubercidin.cdx
csChFnd80/06042111292D

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M  END
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3224

>  <Formula> (298)
C11H13IN4O4

>  <MolWeight> (298)
392.14979

>  <Cat> (298)
S8314

>  <Name> (298)
5-Iodotubercidin

>  <Synonyms> (298)
NSC 113939, 5-ITu

>  <Target> (298)
Adenosine Receptor

>  <Form> (298)
Free Base

>  <CAS> (298)
24386-93-4

>  <URL> (298)
http://www.selleckchem.com/products/5-iodotubercidin.html

$$$$
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csChFnd80/06042111292D

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 23 25  1  6  0  0  0
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 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
  7 31  1  1  0  0  0
M  END
>  <Mol_ID> (299)
3232

>  <Formula> (299)
C29H50O2

>  <MolWeight> (299)
430.7061

>  <Cat> (299)
S4686

>  <Name> (299)
Vitamin E

>  <Synonyms> (299)
	Alpha-Tocopherol, D-alpha-Tocopherol, 5,7,8-Trimethyltocol|(+)-alpha-Tocopherol

>  <Target> (299)
COX,VEGFR

>  <Form> (299)
Free Base

>  <CAS> (299)
21590

>  <URL> (299)
http://www.selleckchem.com/products/vitamin-e.html

$$$$
7,8-Dihydroxyflavone.cdx
csChFnd80/06042111292D

 19 21  0  0  0  0  0  0  0  0999 V2000
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    1.4000    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
    6.0622    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  6 11  1  0  0  0  0
  1 12  1  0  0  0  0
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 19 14  1  0  0  0  0
M  END
>  <Mol_ID> (300)
3237

>  <Formula> (300)
C15H10O4

>  <MolWeight> (300)
254.2375

>  <Cat> (300)
S8319

>  <Name> (300)
7,8-Dihydroxyflavone

>  <Synonyms> (300)
7,8-DHF

>  <Target> (300)
Trk receptor

>  <Form> (300)
Free Base

>  <CAS> (300)
38183-03-8

>  <URL> (300)
http://www.selleckchem.com/products/7-8-dihydroxyflavone.html

$$$$
MLR-1023.cdx
csChFnd80/06042111292D

 15 16  0  0  0  0  0  0  0  0999 V2000
    1.2124    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
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  6  1  1  0  0  0  0
  2  7  2  0  0  0  0
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 14  9  1  0  0  0  0
 11 15  1  0  0  0  0
M  END
>  <Mol_ID> (301)
3241

>  <Formula> (301)
C11H10N2O2

>  <MolWeight> (301)
202.2093

>  <Cat> (301)
S8321

>  <Name> (301)
MLR-1023

>  <Synonyms> (301)
Tolimidone, CP-26154

>  <Target> (301)
Others

>  <Form> (301)
Free Base

>  <CAS> (301)
41964-07-2

>  <URL> (301)
http://www.selleckchem.com/products/mlr-1023.html

$$$$
VO-Ohpic.cdx
csChFnd80/06042111292D

 27 27  0  0  0  0  0  0  0  0999 V2000
    4.4584    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4584    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6709    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8833    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8833    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6709    5.6000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0957    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3082    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    9.3082    3.5000    0.0000 V   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5206    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7330    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7330    3.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.9455    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1579    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1579    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9455    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 10  1  0  0  0  0
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 13 14  1  0  0  0  0
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M  END
>  <Mol_ID> (302)
3261

>  <Formula> (302)
C12H15N2O11V

>  <MolWeight> (302)
414.1958

>  <Cat> (302)
S8174

>  <Name> (302)
VO-Ohpic trihydrate

>  <Synonyms> (302)
N/A

>  <Target> (302)
Others

>  <Form> (302)
trihydrate

>  <CAS> (302)
476310-60-8

>  <URL> (302)
http://www.selleckchem.com/products/vo-ohpic.html

$$$$
EAI045.cdx
csChFnd80/06042111292D

 27 30  0  0  0  0  0  0  0  0999 V2000
    4.6406    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6406    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8531    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.8531    4.2000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (303)
3266

>  <Formula> (303)
C19H14FN3O3S

>  <MolWeight> (303)
383.3961632

>  <Cat> (303)
S8242

>  <Name> (303)
EAI045

>  <Synonyms> (303)
N/A

>  <Target> (303)
EGFR

>  <Form> (303)
Free Base

>  <CAS> (303)
1942114-09-1

>  <URL> (303)
http://www.selleckchem.com/products/eai045.html

$$$$
BAY-61-3606.cdx
csChFnd80/06042111292D

 31 32  0  0  0  0  0  0  0  0999 V2000
   16.9421    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (304)
3273

>  <Formula> (304)
C20H20Cl2N6O3

>  <MolWeight> (304)
463.3172

>  <Cat> (304)
S7006

>  <Name> (304)
BAY-61-3606

>  <Synonyms> (304)
N/A

>  <Target> (304)
Syk

>  <Form> (304)
dihydrochloride

>  <CAS> (304)
648903-57-5

>  <URL> (304)
http://www.selleckchem.com/products/bay-61-3606.html

$$$$
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>  <Target> (305)
Trk receptor

>  <Form> (305)
sulfate

>  <CAS> (305)
1223405-08-0

>  <URL> (305)
http://www.selleckchem.com/products/loxo-101.html

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>  <Name> (306)
APS-2-79 HCl

>  <Synonyms> (306)
N/A

>  <Target> (306)
MEK

>  <Form> (306)
hydrochloride

>  <CAS> (306)
2002381-31-7

>  <URL> (306)
http://www.selleckchem.com/products/aps-2-79.html

$$$$
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NSC228155

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EGFR

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Free Base

>  <CAS> (307)
113104-25-9

>  <URL> (307)
http://www.selleckchem.com/products/nsc228155.html

$$$$
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JAK

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1271022-90-2

>  <URL> (308)
http://www.selleckchem.com/products/bms-911543.html

$$$$
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861875-60-7

>  <URL> (309)
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csChFnd80/06042111292D

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Free Base

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890128-81-1

>  <URL> (310)
http://www.selleckchem.com/products/bfh772.html

$$$$
NT157.cdx
csChFnd80/06042111292D

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3311

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C16H14BrNO5S

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NT157

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N/A

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IGF-1R

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Free Base

>  <CAS> (311)
1384426-12-3

>  <URL> (311)
http://www.selleckchem.com/products/nt157.html

$$$$
RO9021.cdx
csChFnd80/06042111292D

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>  <Formula> (312)
C18H25N7O

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355.4374

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RO9021

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N/A

>  <Target> (312)
Syk

>  <Form> (312)
Free Base

>  <CAS> (312)
1446790-62-0

>  <URL> (312)
http://www.selleckchem.com/products/ro9021.html

$$$$
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csChFnd80/06042111292D

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937263-43-9

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http://www.selleckchem.com/products/arry-380-ont-380.html

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c-Met

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Free Base

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1206799-15-6

>  <URL> (314)
http://www.selleckchem.com/products/ly2801653-merestinib.html

$$$$
GDC-0084.cdx
csChFnd80/06042111292D

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PI3K

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1382979-44-3

>  <URL> (315)
http://www.selleckchem.com/products/gdc-0084.html

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csChFnd80/06042111292D

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1228013-15-7

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$$$$
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1346242-81-6

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Sodium ferulate

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Ferulic acid sodium salt

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Thrombin

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24276-84-4

>  <URL> (321)
http://www.selleckchem.com/products/ferulic-acid-sodium.html

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c-Met  & FGFR

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Free Base

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1265965-22-7

>  <URL> (322)
http://www.selleckchem.com/products/s49076.html

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CCT196969

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Raf

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Free Base

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1163719-56-9

>  <URL> (323)
http://www.selleckchem.com/products/cct196969.html

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FLT3

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Free Base

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1370256-78-2

>  <URL> (324)
http://www.selleck.cn/products/sklb4771-flt3-in1.html

$$$$
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M  END
>  <Mol_ID> (325)
3383

>  <Formula> (325)
C30H42N8O3

>  <MolWeight> (325)
562.70628

>  <Cat> (325)
S8412

>  <Name> (325)
ASP8273 (Naquotinib)

>  <Synonyms> (325)
N/A

>  <Target> (325)
EGFR

>  <Form> (325)
Free Base

>  <CAS> (325)
1448232-80-1

>  <URL> (325)
http://www.selleckchem.com/products/naquotinib-asp8273.html

$$$$
ONO-4059 (GS-4059).cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (326)
3386

>  <Formula> (326)
C25H23ClN6O3

>  <MolWeight> (326)
490.94152

>  <Cat> (326)
S8166

>  <Name> (326)
ONO-4059 (GS-4059) hydrochloride

>  <Synonyms> (326)
N/A

>  <Target> (326)
BTK

>  <Form> (326)
hydrochloride

>  <CAS> (326)
1439901-97-9

>  <URL> (326)
http://www.selleckchem.com/products/ono-4059-gs-4059.html

$$$$
SUN11602.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (327)
3396

>  <Formula> (327)
C26H37N5O2

>  <MolWeight> (327)
451.60428

>  <Cat> (327)
S8192

>  <Name> (327)
SUN11602

>  <Synonyms> (327)
N/A

>  <Target> (327)
FGFR

>  <Form> (327)
Free Base

>  <CAS> (327)
704869-38-5

>  <URL> (327)
http://www.selleckchem.com/products/sun11602.html

$$$$
Nazartinib (EGF816, NVS-816).cdx
csChFnd80/06042111292D

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Nazartinib (EGF816, NVS-816)

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N/A

>  <Target> (328)
EGFR

>  <Form> (328)
Free Base

>  <CAS> (328)
1508250-71-2

>  <URL> (328)
http://www.selleckchem.com/products/nazartinib-egf816-nvs-816.html

$$$$
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PD-166866

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N/A

>  <Target> (329)
FGFR

>  <Form> (329)
Free Base

>  <CAS> (329)
192705-79-6

>  <URL> (329)
http://www.selleckchem.com/products/pd-166866.html

$$$$
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C24H24Cl2N4O4

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BLU-554

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N/A

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FGFR

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Free Base

>  <CAS> (330)
1707289-21-1

>  <URL> (330)
http://www.selleckchem.com/products/blu-554.html

$$$$
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GSK2256098

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FAK

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Free Base

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1224887-10-8

>  <URL> (331)
http://www.selleckchem.com/products/gsk2256098.html

$$$$
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Syk

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hydrochloride salt

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>  <Mol_ID> (333)
3433

>  <Formula> (333)
C22H19F4N7O

>  <MolWeight> (333)
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>  <Cat> (333)
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>  <Name> (333)
AD80

>  <Synonyms> (333)
N/A

>  <Target> (333)
Raf,Src,S6 Kinase,RET V804M,RET V804L,RET wt

>  <Form> (333)
free base

>  <CAS> (333)
1384071-99-1

>  <URL> (333)
http://www.selleckchem.com/products/ad80.html

$$$$
RXDX-106 (CEP-40783).cdx
csChFnd80/06042111292D

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>  <Mol_ID> (334)
3436

>  <Formula> (334)
C31H26F2N4O6

>  <MolWeight> (334)
588.5581464

>  <Cat> (334)
S8570

>  <Name> (334)
RXDX-106 (CEP-40783)

>  <Synonyms> (334)
N/A

>  <Target> (334)
Axl,c-Met,Tyro3,MER,Tyro3,VEGFR2

>  <Form> (334)
free base

>  <CAS> (334)
1437321-24-8

>  <URL> (334)
http://www.selleckchem.com/products/rxdx-106-cep-40783.html

$$$$
Sitravatinib (MGCD516 ).cdx
csChFnd80/06042111292D

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>  <Mol_ID> (335)
3443

>  <Formula> (335)
C33H29F2N5O4S

>  <MolWeight> (335)
629.6762664

>  <Cat> (335)
S8573

>  <Name> (335)
Sitravatinib (MGCD516)

>  <Synonyms> (335)
MG-516

>  <Target> (335)
DDR2,EPHA3,Axl,Mer,FLT4,KDR,NTRK1,FLT1,etc

>  <Form> (335)
free base

>  <CAS> (335)
1123837-84-2

>  <URL> (335)
http://www.selleckchem.com/products/sitravatinib-mgcd516.html

$$$$
TPX-0005.cdx
csChFnd80/06042111292D

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N/A

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 ALK,ALK(L1196M),ALK(G1202R),Src 

>  <Form> (336)
free base

>  <CAS> (336)
no

>  <URL> (336)
http://www.selleckchem.com/products/tpx-0005.html

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TAK-659.cdx
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>  <Cat> (337)
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>  <Name> (337)
TAK-659

>  <Synonyms> (337)
N/A

>  <Target> (337)
Syk,FLT3,ZAP-70,JAK3,VEGFR2

>  <Form> (337)
hydrochloride 

>  <CAS> (337)
1952251-28-3

>  <URL> (337)
http://www.selleckchem.com/products/tak-659.html

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PF-06273340.cdx
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>  <Mol_ID> (338)
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>  <Formula> (338)
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>  <Cat> (338)
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>  <Name> (338)
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>  <Synonyms> (338)
N/A

>  <Target> (338)
TrkC,TrkB,TrkA

>  <Form> (338)
free base

>  <CAS> (338)
1402438-74-7

>  <URL> (338)
http://www.selleckchem.com/products/pf-06273340.html

$$$$
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csChFnd80/06042111292D

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>  <Formula> (339)
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>  <Cat> (339)
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>  <Name> (339)
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>  <Synonyms> (339)
N/A

>  <Target> (339)
ALK,TRK

>  <Form> (339)
free base

>  <CAS> (339)
1357920-84-3

>  <URL> (339)
http://www.selleckchem.com/products/tsr-011-belizatinib.html

$$$$
PRN1371.cdx
csChFnd80/06042111292D

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PRN1371

>  <Synonyms> (340)
N/A

>  <Target> (340)
FGFR1,FGFR2,FGFR3,CSF1R,FGFR4

>  <Form> (340)
free base

>  <CAS> (340)
1802929-43-6

>  <URL> (340)
http://www.selleckchem.com/products/prn1371.html

$$$$
Gilteritinib (ASP2215).cdx
csChFnd80/06042111292D

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>  <Mol_ID> (341)
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>  <Formula> (341)
C29H44N8O3

>  <MolWeight> (341)
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>  <Cat> (341)
S7754

>  <Name> (341)
Gilteritinib (ASP2215)

>  <Synonyms> (341)
N/A

>  <Target> (341)
FLT3,Axl 

>  <Form> (341)
free base

>  <CAS> (341)
1254053-43-4

>  <URL> (341)
http://www.selleckchem.com/products/gilteritinib-asp2215.html

$$$$
CA-4948.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (342)
3518

>  <Formula> (342)
C21H19N7O3

>  <MolWeight> (342)
417.42066

>  <Cat> (342)
S8562

>  <Name> (342)
CA-4948

>  <Synonyms> (342)
N/A

>  <Target> (342)
IRAK4

>  <Form> (342)
free base

>  <CAS> (342)
1801343-74-7

>  <URL> (342)
http://www.selleckchem.com/products/ca-4948.html

$$$$
H3B-6527.cdx
csChFnd80/06042111292D

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   19.3990    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    4.2000    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
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  2  7  1  0  0  0  0
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  5  9  1  0  0  0  0
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 10 12  2  0  0  0  0
 11 13  2  0  0  0  0
  7 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 17 18  1  0  0  0  0
 18  7  1  0  0  0  0
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 19 20  1  0  0  0  0
  9 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
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 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 21  1  0  0  0  0
 23 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  2  0  0  0  0
 30 32  1  0  0  0  0
 32 33  2  0  0  0  0
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 34 35  2  0  0  0  0
 35 36  1  0  0  0  0
 36 37  2  0  0  0  0
 37 32  1  0  0  0  0
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 36 40  1  0  0  0  0
 34 41  1  0  0  0  0
 41 42  1  0  0  0  0
 40 43  1  0  0  0  0
M  END
>  <Mol_ID> (343)
3531

>  <Formula> (343)
C29H34Cl2N8O4

>  <MolWeight> (343)
629.53746

>  <Cat> (343)
S8675

>  <Name> (343)
H3B-6527

>  <Synonyms> (343)
N/A

>  <Target> (343)
FGFR4

>  <Form> (343)
free base

>  <CAS> (343)
1702259-66-2

>  <URL> (343)
http://www.selleckchem.com/products/h3b-6527.html

$$$$
S5115 Sodium L-ascorbyl-2-phosphate.cdx
csChFnd80/06042111292D

 20 17  0  0  0  0  0  0  0  0999 V2000
    4.7611    3.6858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3521    3.6977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2131    5.0602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5731    2.5453    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5143    2.5760    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.0767    5.8608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5423    5.4996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9921    1.2735    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    1.6080    5.5489    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7231    1.8531    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4104    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.2700    0.6897    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.3514    6.9251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5444    4.6385    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0312    7.3911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9024    0.0211    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  2  0  0  0  0
  9 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
 10 15  1  1  0  0  0
 14 16  1  0  0  0  0
  5 20  1  6  0  0  0
M  END
>  <Mol_ID> (344)
3576

>  <Formula> (344)
C6H6Na3O9P

>  <MolWeight> (344)
322.049511

>  <Cat> (344)
S5115

>  <Name> (344)
Sodium L-ascorbyl-2-phosphate

>  <Synonyms> (344)
Sodium ascorbyl monophosphate, Sodium ascorbyl phosphate

>  <Target> (344)
Others

>  <Form> (344)
sodium salt

>  <CAS> (344)
66170-10-3

>  <URL> (344)
http://www.selleckchem.com/products/sodium-l-ascorbyl-2-phosphate.html

$$$$
PF-06651600.cdx
csChFnd80/06042111292D

 21 23  0  0  0  0  0  0  0  0999 V2000
    4.8497    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.6061    0.2674    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.4290    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6061    2.5326    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 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.8497    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.3000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.4249    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  5  1  0  0  0  0
  6 10  1  0  0  0  0
 11 10  1  1  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 11  1  0  0  0  0
 14 17  1  1  0  0  0
 15 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (345)
3579

>  <Formula> (345)
C15H19N5O

>  <MolWeight> (345)
285.34426

>  <Cat> (345)
S8538

>  <Name> (345)
PF-06651600

>  <Synonyms> (345)
N/A

>  <Target> (345)
JAK3 

>  <Form> (345)
free base

>  <CAS> (345)
1792180-81-4

>  <URL> (345)
http://www.selleckchem.com/products/pf-06651600.html

$$$$
2-D08.cdx
csChFnd80/06042111292D

 20 22  0  0  0  0  0  0  0  0999 V2000
    0.0000    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.5000    0.0000 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
    8.4870    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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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
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  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
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 17 12  1  0  0  0  0
 17 18  1  0  0  0  0
 16 19  1  0  0  0  0
 15 20  1  0  0  0  0
M  END
>  <Mol_ID> (346)
3605

>  <Formula> (346)
C15H10O5

>  <MolWeight> (346)
270.2369

>  <Cat> (346)
S8696

>  <Name> (346)
2-D08
2-D08

>  <Synonyms> (346)
2',3',4'-trihydroxy flavone

>  <Target> (346)
c-RET,SUMO,TAM Receptor,IL Receptor,PI3K,VEG

>  <Form> (346)
free base

>  <CAS> (346)
144707-18-6

>  <URL> (346)
http://selleckchem.com/products/2-d08.html

$$$$
S5077 Regorafenib Monohydrate.cdx
csChFnd80/06042111292D

 34 35  0  0  0  0  0  0  0  0999 V2000
   16.9741    4.5330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    5.2330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    4.5330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    3.1330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    3.1330    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    5.2330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    6.6330    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    4.5330    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    5.2330    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    4.5330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    5.2330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.5330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    3.1330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    3.1330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    5.2330    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    2.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5124    3.6455    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.9124    1.2206    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.7330    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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   20.6114    5.2330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0132    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  2  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  1  7  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 16  1  0  0  0  0
 11 16  2  0  0  0  0
 10 11  1  0  0  0  0
 13 17  1  0  0  0  0
 19 20  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
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 22 27  2  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
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  3 10  1  0  0  0  0
  9 33  1  0  0  0  0
M  END
>  <Mol_ID> (347)
3648

>  <Formula> (347)
C21H17ClF4N4O4

>  <MolWeight> (347)
500.8306928

>  <Cat> (347)
S5077

>  <Name> (347)
Regorafenib Monohydrate

>  <Synonyms> (347)
N/A

>  <Target> (347)
VEGFR,PDGFR,c-Kit,c-RET,Raf

>  <Form> (347)
monohydrate

>  <CAS> (347)
1019206-88-2

>  <URL> (347)
http://selleckchem.com/products/regorafenib-monohydrate.html

$$$$
BGB-3111.cdx
csChFnd80/06042111292D

 32 35  0  0  0  0  0  0  0  0999 V2000
    8.7440    4.0912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.9565    1.9912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1689    2.6912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1689    4.0912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.5316    4.7912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3813    1.9912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5938    2.6912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8062    1.9912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0187    2.6912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0187    4.0912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8062    4.7912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5938    4.0912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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>  <Mol_ID> (348)
3661

>  <Formula> (348)
C24H25N5O3

>  <MolWeight> (348)
431.487

>  <Cat> (348)
S8542

>  <Name> (348)
Btk inhibitor 2

>  <Synonyms> (348)
N/A

>  <Target> (348)
BTK

>  <Form> (348)
free base

>  <CAS> (348)
1558036-85-3

>  <URL> (348)
http://selleckchem.com/products/btk-inhibitor-2.html

$$$$
BMS-935177.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (349)
3674

>  <Formula> (349)
C31H26N4O3

>  <MolWeight> (349)
502.56314

>  <Cat> (349)
S8348

>  <Name> (349)
BMS-935177

>  <Synonyms> (349)
N/A

>  <Target> (349)
BTK,Trk receptor,c-RET

>  <Form> (349)
free base

>  <CAS> (349)
1231889-53-4

>  <URL> (349)
http://selleckchem.com/products/bms-935177.html

$$$$
Asciminib(ABL001).cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (350)
3681

>  <Formula> (350)
C20H18ClF2N5O3

>  <MolWeight> (350)
449.8384264

>  <Cat> (350)
S8555

>  <Name> (350)
Asciminib (ABL001)

>  <Synonyms> (350)
N/A

>  <Target> (350)
Bcr-Abl

>  <Form> (350)
free base

>  <CAS> (350)
1492952-76-7

>  <URL> (350)
http://selleckchem.com/products/asciminib-abl001.html

$$$$
RAF709.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (351)
3697

>  <Formula> (351)
C28H29F3N4O4

>  <MolWeight> (351)
542.5494696

>  <Cat> (351)
S8690

>  <Name> (351)
RAF709

>  <Synonyms> (351)
N/A

>  <Target> (351)
Raf

>  <Form> (351)
free base

>  <CAS> (351)
1628838-42-5

>  <URL> (351)
http://selleckchem.com/products/raf709.html

$$$$
S5060 Metadoxine.cdx
csChFnd80/06042111292D

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    3.6360    2.1008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (352)
3725

>  <Formula> (352)
C13H18N2O6

>  <MolWeight> (352)
298.29182

>  <Cat> (352)
S5060

>  <Name> (352)
 Metadoxine

>  <Synonyms> (352)
Metadoxil, Metasin, pyridoxine-pyrrolidone carboxylat

>  <Target> (352)
Others

>  <Form> (352)
salt

>  <CAS> (352)
74536-44-0

>  <URL> (352)
http://selleckchem.com/products/metadoxine.html

$$$$
S5321 Y15.cdx
csChFnd80/06042111292D

 14 10  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (353)
3747

>  <Formula> (353)
C6H14Cl4N4

>  <MolWeight> (353)
284.01416

>  <Cat> (353)
S5321

>  <Name> (353)
Y15

>  <Synonyms> (353)
1,2,4,5-Benzenetetraamine tetrahydrochloride

>  <Target> (353)
FAK

>  <Form> (353)
tetrahydrochloride 

>  <CAS> (353)
4506-66-5

>  <URL> (353)
http://selleckchem.com/products/y15.html

$$$$
AZD1390.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (354)
3766

>  <Formula> (354)
C27H32FN5O2

>  <MolWeight> (354)
477.5736832

>  <Cat> (354)
S8680

>  <Name> (354)
AZD1390

>  <Synonyms> (354)
N/A

>  <Target> (354)
ATM/ATR

>  <Form> (354)
free base

>  <CAS> (354)
2089288-03-7

>  <URL> (354)
http://selleckchem.com/products/azd1390.html

$$$$
S5098 Gefitinib hydrochloride.cdx
csChFnd80/06042111292D

 32 34  0  0  0  0  0  0  0  0999 V2000
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   12.1579    7.0386    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (355)
3768

>  <Formula> (355)
C22H25Cl2FN4O3

>  <MolWeight> (355)
483.3633032

>  <Cat> (355)
S5098

>  <Name> (355)
Gefitinib hydrochloride

>  <Synonyms> (355)
ZD1839 hydrochloride

>  <Target> (355)
EGFR

>  <Form> (355)
hydrochloride 

>  <CAS> (355)
184475-55-6

>  <URL> (355)
http://selleckchem.com/products/gefitinib-hydrochloride.html

$$$$
bpV (HOpic).cdx
csChFnd80/06042111292D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (356)
3819

>  <Formula> (356)
C6H4K2NO8V

>  <MolWeight> (356)
347.23596

>  <Cat> (356)
S8651

>  <Name> (356)
bpV (HOpic)

>  <Synonyms> (356)
Bisperoxovanadium(HOpic)

>  <Target> (356)
PTEN

>  <Form> (356)
potassium 

>  <CAS> (356)
722494-26-0

>  <URL> (356)
http://selleckchem.com/products/bpv-hopic.html

$$$$
Anlotinib (AL3818).cdx
csChFnd80/06042111292D

 32 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (357)
3821

>  <Formula> (357)
C23H24Cl2FN3O3

>  <MolWeight> (357)
480.3593632

>  <Cat> (357)
S8726

>  <Name> (357)
Anlotinib (AL3818) dihydrochloride

>  <Synonyms> (357)
N/A

>  <Target> (357)
VEGFR

>  <Form> (357)
dihydrochloride 

>  <CAS> (357)
1360460-82-7

>  <URL> (357)
http://selleckchem.com/products/anlotinib-al3818.html

$$$$
DCC-2618.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (358)
3822

>  <Formula> (358)
C26H21F2N5O3

>  <MolWeight> (358)
489.4734464

>  <Cat> (358)
S8721

>  <Name> (358)
DCC-2618

>  <Synonyms> (358)
N/A

>  <Target> (358)
c-Kit

>  <CAS> (358)
 1225278-16-9

>  <URL> (358)
http://selleckchem.com/products/dcc-2618.html

$$$$
S5069 Dabrafenib Mesylate.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (359)
3841

>  <Formula> (359)
C24H24F3N5O5S3

>  <MolWeight> (359)
615.6680696

>  <Cat> (359)
S5069

>  <Name> (359)
Dabrafenib Mesylate

>  <Synonyms> (359)
GSK2118436 Mesylate

>  <Target> (359)
Raf

>  <Form> (359)
mesylate

>  <CAS> (359)
1195768-06-9

>  <URL> (359)
http://selleckchem.com/products/dabrafenib-mesylate.html

$$$$
S5234 Nintedanib Ethanesulfonate Salt.cdx
csChFnd80/06042111292D

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   16.9801    9.9170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3424   11.2693    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.3525   12.2592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0002   11.8969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6947   11.6316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9362   11.8710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4689    4.7011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6813    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2565    4.0011    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   15.9565    2.7886    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5565    5.2135    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0440    3.3011    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
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  1  9  1  0  0  0  0
  4  9  2  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
  7 10  1  0  0  0  0
  2 13  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 15 20  2  0  0  0  0
 14 15  1  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
 22 27  2  0  0  0  0
 29 30  2  0  0  0  0
 29 31  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 37  1  0  0  0  0
 32 37  1  0  0  0  0
 35 38  1  0  0  0  0
 31 32  1  0  0  0  0
 28 29  1  0  0  0  0
 28 39  1  0  0  0  0
 25 28  1  0  0  0  0
 21 22  1  0  0  0  0
 14 21  1  0  0  0  0
  3 14  2  0  0  0  0
 12 40  1  0  0  0  0
 41 42  1  0  0  0  0
 43 44  2  0  0  0  0
 43 45  2  0  0  0  0
 43 46  1  0  0  0  0
 41 43  1  0  0  0  0
M  END
>  <Mol_ID> (360)
3858

>  <Formula> (360)
C33H39N5O7S

>  <MolWeight> (360)
649.75706

>  <Cat> (360)
S5234

>  <Name> (360)
Nintedanib Ethanesulfonate Salt

>  <Synonyms> (360)
Intedanib, BIBF 1120

>  <Target> (360)
VEGFR,FGFR,PDGFR

>  <Form> (360)
ethanesulfonate 

>  <CAS> (360)
656247-18-6

>  <URL> (360)
http://selleckchem.com/products/nintedanib-ethanesulfonate-salt.html

$$$$
S5242 Cediranib Maleate.cdx
csChFnd80/06042111292D

 41 44  0  0  0  0  0  0  0  0999 V2000
   10.8290    3.6882    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6166    2.9882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4041    3.6882    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4041    5.0882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6166    5.7882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6166    7.1882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8290    7.8882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0414    7.1882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0414    5.7882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8290    5.0882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2539    7.8882    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4663    7.1882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6787    7.8882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8912    7.1882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1036    7.8882    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.2500    9.2806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6194    9.5717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3194    8.3592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3826    7.3188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8290    9.2882    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0414    9.9882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1917    5.7882    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2229    3.2556    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    4.3882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2229    5.5209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5544    5.0882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7668    5.7882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9792    5.0882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9792    3.6882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7668    2.9882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5544    3.6882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.3882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7668    7.1882    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   16.7509    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9633    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7509    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9591    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9633    5.5879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1715    3.4951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.9591    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1673    2.0927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  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
  1 10  2  0  0  0  0
  5 10  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 11 12  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
 15 19  1  0  0  0  0
 14 15  1  0  0  0  0
  8 11  1  0  0  0  0
 20 21  1  0  0  0  0
  7 20  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 23 31  1  0  0  0  0
 26 31  2  0  0  0  0
 24 32  1  0  0  0  0
 27 33  1  0  0  0  0
 22 28  1  0  0  0  0
  4 22  1  0  0  0  0
 34 35  1  0  0  0  0
 34 36  2  0  0  0  0
 36 37  1  0  0  0  0
 35 38  2  0  0  0  0
 35 39  1  0  0  0  0
 37 40  2  0  0  0  0
 37 41  1  0  0  0  0
M  END
>  <Mol_ID> (361)
3860

>  <Formula> (361)
C29H31FN4O7

>  <MolWeight> (361)
566.5774432

>  <Cat> (361)
S5242

>  <Name> (361)
Cediranib Maleate

>  <Synonyms> (361)
AZD-2171 maleate

>  <Target> (361)
VEGFR

>  <Form> (361)
maleate

>  <CAS> (361)
 857036-77-2

>  <URL> (361)
http://selleckchem.com/products/cediranib-maleate.html

$$$$
UM-164.cdx
csChFnd80/06042111292D

 45 49  0  0  0  0  0  0  0  0999 V2000
    7.2746    4.8418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.4418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.7418    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    3.4418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.8418    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    5.5418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.7418    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.7418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    6.9418    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    7.6418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9784    7.0724    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.9152    8.1128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2152    9.3252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8458    9.0342    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3076    7.9665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1305    9.0991    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.8770    6.6875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5228    8.9527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0922    7.6738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4846    7.5274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3075    8.6601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7380    9.9390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3457   10.0854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0540    6.2485    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7763   11.3643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4463    6.1021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0157    4.8232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2692    7.2348    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1928    3.6906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7623    2.4116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1546    2.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9775    3.3979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.4081    4.6768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9394    1.2790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.4418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.7418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.3418    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.6418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.3418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.6418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.3418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.6418    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   17.5470    1.4253    0.0000 F   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
  2  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
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 15 16  1  0  0  0  0
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 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
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 22 23  2  0  0  0  0
 23 18  1  0  0  0  0
 20 24  1  0  0  0  0
 23 25  1  0  0  0  0
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 26 27  1  0  0  0  0
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 27 29  2  0  0  0  0
 29 30  1  0  0  0  0
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 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 27  1  0  0  0  0
 30 34  1  0  0  0  0
  7 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 39  7  1  0  0  0  0
 37 40  1  0  0  0  0
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 34 43  1  0  0  0  0
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M  END
>  <Mol_ID> (362)
4011

>  <Formula> (362)
C30H31F3N8O3S

>  <MolWeight> (362)
640.6791496

>  <Cat> (362)
S8706

>  <Name> (362)
UM-164

>  <Synonyms> (362)
N/A

>  <Target> (362)
Src,p38 MAPK

>  <Form> (362)
free base

>  <CAS> (362)
903564-48-7

>  <URL> (362)
http://selleckchem.com/products/um-164.html

$$$$
S5205 Nilotinib  hydrochloride.cdx
csChFnd80/06042111292D

 40 43  0  0  0  0  0  0  0  0999 V2000
   12.1246    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9121    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6996    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873    0.6998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6996    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9121    0.6998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1246    4.1998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371    2.0998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748    2.7998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8500    2.7998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6375    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6375    0.6998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8500    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    0.6998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    4.1999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2126    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.7997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0002    4.1997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2126    4.8997    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5494    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7619    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9744    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9744    4.1998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7619    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5494    4.1998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (363)
4022

>  <Formula> (363)
C28H23ClF3N7O

>  <MolWeight> (363)
565.9767296

>  <Cat> (363)
S5205

>  <Name> (363)
Nilotinib hydrochloride

>  <Synonyms> (363)
AMN-107 HCl

>  <Target> (363)
Bcr-Abl

>  <Form> (363)
hydrochloride 

>  <CAS> (363)
923288-95-3

>  <URL> (363)
http://selleckchem.com/products/nilotinib-hydrochloride.html

$$$$
S5240 lenvatinib Mesylate.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (364)
4024

>  <Formula> (364)
C22H23ClN4O7S

>  <MolWeight> (364)
522.95862

>  <Cat> (364)
S5240

>  <Name> (364)
lenvatinib Mesylate

>  <Synonyms> (364)
N/A

>  <Target> (364)
VEGFR

>  <Form> (364)
Mesylate

>  <CAS> (364)
 857890-39-2

>  <URL> (364)
http://selleckchem.com/products/lenvatinib-mesylate.html

$$$$
S5272 Toceranib phosphate.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (365)
4029

>  <Formula> (365)
C22H28FN4O6P

>  <MolWeight> (365)
494.4530842

>  <Cat> (365)
S5272

>  <Name> (365)
Toceranib phosphate

>  <Synonyms> (365)
SU11654

>  <Target> (365)
PDGFR¦Â

>  <Form> (365)
phosphate 

>  <CAS> (365)
874819-74-6

>  <URL> (365)
http://selleckchem.com/products/.html

$$$$
ARQ 531.cdx
csChFnd80/06042111292D

 34 38  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (366)
4047

>  <Formula> (366)
C25H23ClN4O4

>  <MolWeight> (366)
478.92752

>  <Cat> (366)
S8711

>  <Name> (366)
ARQ 531

>  <Synonyms> (366)
N/A

>  <Target> (366)
BTK

>  <Form> (366)
free base

>  <CAS> (366)
2095393-15-8

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

$$$$
Lazertinib (YH25448,GNS-1480).cdx
csChFnd80/06042111292D

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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
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  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
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  5  9  1  0  0  0  0
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 13 14  2  0  0  0  0
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 22 24  1  0  0  0  0
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 25 26  1  0  0  0  0
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 21 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
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  7 38  1  0  0  0  0
 38 39  1  0  0  0  0
 38 40  2  0  0  0  0
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M  END
>  <Mol_ID> (367)
4075

>  <Formula> (367)
C30H34N8O3

>  <MolWeight> (367)
554.64276

>  <Cat> (367)
S8724

>  <Name> (367)
Lazertinib (YH25448,GNS-1480)

>  <Form> (367)
free base

>  <CAS> (367)
1903008-80-9

$$$$
S9414 Cyasterone.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (368)
4146

>  <Formula> (368)
C29H44O8

>  <MolWeight> (368)
520.65486

>  <Cat> (368)
S9414

>  <Name> (368)
Cyasterone

>  <Form> (368)
free base

>  <CAS> (368)
17086-76-9

$$$$

csChFnd80/06042111292D

 12 12  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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M  END
>  <Mol_ID> (369)
4207

>  <Formula> (369)
C6H6Br6

>  <MolWeight> (369)
557.53584

>  <Cat> (369)
S5902

>  <Name> (369)
1,2,3,4,5,6-Hexabromocyclohexane

>  <Synonyms> (369)
NSC7908

>  <Target> (369)
JAK

>  <Form> (369)
Free Base

>  <CAS> (369)
1837-91-8

>  <URL> (369)
http://www.selleckchem.com/products/hexabromocyclohexane.html

$$$$

csChFnd80/06042111292D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
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M  END
>  <Mol_ID> (370)
4208

>  <Formula> (370)
C16H15N3O3

>  <MolWeight> (370)
297.3086

>  <Cat> (370)
S5903

>  <Name> (370)
JANEX-1

>  <Synonyms> (370)
WHI-P131

>  <Target> (370)
JAK

>  <Form> (370)
Free Base

>  <CAS> (370)
202475-60-3

>  <URL> (370)
http://www.selleckchem.com/products/janex-1.html

$$$$

csChFnd80/06042111292D

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  1  6  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
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 13 14  2  0  0  0  0
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 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
  8 17  2  0  0  0  0
 12 17  1  0  0  0  0
 15 18  1  0  0  0  0
 19 20  1  0  0  0  0
 14 19  1  0  0  0  0
  7 11  1  0  0  0  0
  4  7  1  0  0  0  0
  6 21  1  0  0  0  0
  2 22  1  0  0  0  0
  1 23  1  0  0  0  0
 18 24  1  0  0  0  0
M  END
>  <Mol_ID> (371)
4209

>  <Formula> (371)
C16H13Br2N3O3

>  <MolWeight> (371)
455.10072

>  <Cat> (371)
S5904

>  <Name> (371)
WHI-P97

>  <Synonyms> (371)
N/A

>  <Target> (371)
JAK

>  <Form> (371)
Free Base

>  <CAS> (371)
211555-05-4

>  <URL> (371)
http://www.selleckchem.com/products/whi-p97.html

$$$$

csChFnd80/06042111292D

 29 33  0  0  0  0  0  0  0  0999 V2000
    1.2125    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9125    2.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4834    6.0407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.6958    8.1407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9082    7.4407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.0473    6.2828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0373    4.5682    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
  7  8  1  0  0  0  0
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  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
  7 12  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 12 13  1  0  0  0  0
  7 15  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 16 21  2  0  0  0  0
 22 23  2  0  0  0  0
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 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 24 27  1  0  0  0  0
 22 24  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  0  0  0  0
 19 22  1  0  0  0  0
 11 16  1  0  0  0  0
  6 14  1  0  0  0  0
M  END
>  <Mol_ID> (372)
4220

>  <Formula> (372)
C22H23N5O2

>  <MolWeight> (372)
389.45032

>  <Cat> (372)
S5917

>  <Name> (372)
Solcitinib

>  <Synonyms> (372)
GLPG0778, GSK2586184

>  <Target> (372)
JAK

>  <Form> (372)
Free Base

>  <CAS> (372)
1206163-45-2

>  <URL> (372)
http://www.selleckchem.com/products/solcitinib.html

$$$$

csChFnd80/06042111292D

 38 43  0  0  0  0  0  0  0  0999 V2000
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    1.4000    6.5016    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
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 37 31  1  0  0  0  0
 36 38  1  6  0  0  0
M  END
>  <Mol_ID> (373)
4240

>  <Formula> (373)
C25H21F3N6O3S

>  <MolWeight> (373)
542.5328496

>  <Cat> (373)
S7965

>  <Name> (373)
PLX8394

>  <Synonyms> (373)
N/A

>  <Target> (373)
Raf

>  <Form> (373)
Free Base

>  <CAS> (373)
1393466-87-9

>  <URL> (373)
http://www.selleckchem.com/products/plx8394.html

$$$$

csChFnd80/06042111292D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
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 13 15  2  0  0  0  0
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 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
M  END
>  <Mol_ID> (374)
4244

>  <Formula> (374)
C24H28N4O3

>  <MolWeight> (374)
420.50412

>  <Cat> (374)
S8556

>  <Name> (374)
AZ31

>  <Synonyms> (374)
N/A

>  <Target> (374)
ATM/ATR

>  <Form> (374)
Free Base

>  <CAS> (374)
2088113-98-6

>  <URL> (374)
http://www.selleckchem.com/products/az31.html

$$$$

csChFnd80/06042111292D

 35 39  0  0  0  0  0  0  0  0999 V2000
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    2.4249    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    7.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  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  1  0  0  0  0
  8  9  1  0  0  0  0
  4 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 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
 13 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 14  1  0  0  0  0
 17 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 18  1  0  0  0  0
 19 25  1  1  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 25  1  0  0  0  0
 30 31  1  0  0  0  0
  9 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
M  END
>  <Mol_ID> (375)
4247

>  <Formula> (375)
C29H29FN4O

>  <MolWeight> (375)
468.5651632

>  <Cat> (375)
S8609

>  <Name> (375)
Derazantinib(ARQ-087)

>  <Synonyms> (375)
N/A

>  <Target> (375)
FGFR

>  <Form> (375)
Free Base

>  <CAS> (375)
1234356-69-4

>  <URL> (375)
http://www.selleckchem.com/products/derazantinib.html

$$$$

csChFnd80/06042111292D

 35 39  0  0  0  0  0  0  0  0999 V2000
    1.2124    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    0.0000    0.0000 N   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
    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
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.7917    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9688    2.5326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    6.3000    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
    0.0000    7.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.2397    8.1457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0226    9.0623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.0146    2.5326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4787    2.9229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  7 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
 14 15  2  0  0  0  0
 15  7  1  0  0  0  0
 14 16  1  0  0  0  0
 13 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  2  0  0  0  0
 20 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 20  2  0  0  0  0
 23 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  0  0  0  0
  9 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 30  2  0  0  0  0
 33 35  1  0  0  0  0
M  END
>  <Mol_ID> (376)
4250

>  <Formula> (376)
C24H23FN8O2

>  <MolWeight> (376)
474.4902232

>  <Cat> (376)
S8679

>  <Name> (376)
BTK inhibitor 1 (Compound 27)

>  <Synonyms> (376)
N/A

>  <Target> (376)
BTK

>  <Form> (376)
Free Base

>  <CAS> (376)
2230724-66-8

>  <URL> (376)
http://www.selleckchem.com/products/btk-inhibitor-1-compound27.html

$$$$

csChFnd80/06042111292D

 21 23  0  0  0  0  0  0  0  0999 V2000
    2.7374    2.1544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1374    2.1544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8374    3.3668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1374    4.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7374    4.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0374    3.3668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3048    0.8229    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4374    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5700    0.8229    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.8374    5.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2297    5.9380    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5208    7.3074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3084    8.0074    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2680    7.0706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8985    7.3617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3291    8.6407    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9368    8.4943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6457    7.1249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8581    6.4249    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    9.5348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9018    2.7765    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
  1  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  2  1  0  0  0  0
  4 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 10  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 15  1  0  0  0  0
 17 20  1  0  0  0  0
M  END
>  <Mol_ID> (377)
4252

>  <Formula> (377)
C14H11ClN4S2

>  <MolWeight> (377)
334.84694

>  <Cat> (377)
S8700

>  <Name> (377)
TP0427736 HCl

>  <Synonyms> (377)
N/A

>  <Target> (377)
ALK

>  <Form> (377)
hydrochloride

>  <CAS> (377)
864374-00-5

>  <URL> (377)
http://www.selleckchem.com/products/tp0427736-hcl.html

$$$$

csChFnd80/06042111292D

 25 28  0  0  0  0  0  0  0  0999 V2000
    0.0000    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    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
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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 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12  7  2  0  0  0  0
 10 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 11  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 16  1  0  0  0  0
 19 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (378)
4257

>  <Formula> (378)
C20H16N4O

>  <MolWeight> (378)
328.36724

>  <Cat> (378)
S8729

>  <Name> (378)
AZ32

>  <Synonyms> (378)
N/A

>  <Target> (378)
ATM/ATR

>  <Form> (378)
Free Base

>  <CAS> (378)
No CAS

>  <URL> (378)
http://www.selleckchem.com/products/az32.html

$$$$

csChFnd80/06042111292D

 29 32  0  0  0  0  0  0  0  0999 V2000
    3.6373    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    4.2000    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 N   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
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4870    5.6000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  2  8  1  0  0  0  0
  4  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
  7 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  7  1  0  0  0  0
  8 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  8  1  0  0  0  0
 14 25  1  0  0  0  0
 12 29  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
 25 28  1  0  0  0  0
M  END
>  <Mol_ID> (379)
4259

>  <Formula> (379)
C17H20F3N7O2

>  <MolWeight> (379)
411.3816096

>  <Cat> (379)
S8738

>  <Name> (379)
Bimiralisib (PQR309)

>  <Synonyms> (379)
N/A

>  <Target> (379)
PI3K

>  <Form> (379)
Free Base

>  <CAS> (379)
1225037-39-7

>  <URL> (379)
http://www.selleckchem.com/products/pqr309-bimiralisib.html

$$$$

csChFnd80/06042111292D

 36 40  0  0  0  0  0  0  0  0999 V2000
    3.6373   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249   14.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   14.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   14.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    9.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6414   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    5.6000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  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
  8 10  1  0  0  0  0
 10 11  2  0  0  0  0
  4 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 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
 17 19  1  0  0  0  0
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 21 18  1  0  0  0  0
 15 22  1  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
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 27 28  2  0  0  0  0
 28 23  1  0  0  0  0
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 30 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 30  1  0  0  0  0
 33 36  1  0  0  0  0
M  END
>  <Mol_ID> (380)
4260

>  <Formula> (380)
C26H26FN7O2

>  <MolWeight> (380)
487.5287432

>  <Cat> (380)
S8741

>  <Name> (380)
Avitinib (AC0010)

>  <Synonyms> (380)
N/A

>  <Target> (380)
EGFR

>  <Form> (380)
Free Base

>  <CAS> (380)
1557267-42-1

>  <URL> (380)
http://www.selleckchem.com/products/avitinib-ac0010.html

$$$$

csChFnd80/06042111292D

 36 39  0  0  0  0  0  0  0  0999 V2000
    8.4870   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   14.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   12.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   10.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119   16.8000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   17.5000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
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  2  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
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 17 18  2  0  0  0  0
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 22 17  1  0  0  0  0
 19 23  1  0  0  0  0
 21 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
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 28 29  1  0  0  0  0
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 30 31  1  0  0  0  0
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 32 23  1  0  0  0  0
  6 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 35  1  0  0  0  0
 33 36  1  0  0  0  0
M  END
>  <Mol_ID> (381)
4262

>  <Formula> (381)
C25H25F3N4O4

>  <MolWeight> (381)
502.4856096

>  <Cat> (381)
S8745

>  <Name> (381)
LXH254

>  <Synonyms> (381)
N/A

>  <Target> (381)
Raf

>  <Form> (381)
Free Base

>  <CAS> (381)
1800398-38-2

>  <URL> (381)
http://www.selleckchem.com/products/lxh254.html

$$$$

csChFnd80/06042111292D

 29 31  0  0  0  0  0  0  0  0999 V2000
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    3.6331    9.0903    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8909    6.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0991    5.5976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8909    7.6903    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
  6  7  1  0  0  0  0
  2 10  1  0  0  0  0
  3 11  1  0  0  0  0
  5 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 16  1  0  0  0  0
 11 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 11  1  0  0  0  0
 27 28  1  0  0  0  0
 27 20  1  0  0  0  0
 27 29  2  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
M  END
>  <Mol_ID> (382)
4266

>  <Formula> (382)
C19H15N3O6S

>  <MolWeight> (382)
413.4039

>  <Cat> (382)
S8754

>  <Name> (382)
Alofanib(RPT835)

>  <Synonyms> (382)
N/A

>  <Target> (382)
FGFR

>  <Form> (382)
Free Base

>  <CAS> (382)
1612888-66-0

>  <URL> (382)
http://www.selleckchem.com/products/alofanib-rpt835.html

$$$$

csChFnd80/06042111292D

 33 36  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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   13.3368    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5492    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7617    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (383)
4268

>  <Formula> (383)
C24H21BrFN5O2

>  <MolWeight> (383)
510.3582432

>  <Cat> (383)
S8757

>  <Name> (383)
Ripretinib (DCC-2618)

>  <Synonyms> (383)
N/A

>  <Target> (383)
c-Kit

>  <Form> (383)
Free Base

>  <CAS> (383)
1442472-39-0

>  <URL> (383)
http://www.selleckchem.com/products/ripretinib-dcc-2618.html

$$$$
S9031 Gambogenic acid.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (384)
4286

>  <Formula> (384)
C38H46O8

>  <MolWeight> (384)
630.76704

>  <Cat> (384)
S9031

>  <Name> (384)
Gambogenic acid

>  <Form> (384)
free base

>  <CAS> (384)
173932-75-7

$$$$
S9084 Rhoifolin.cdx
csChFnd80/06042111292D

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4327

>  <Formula> (385)
C27H30O14

>  <MolWeight> (385)
578.5187

>  <Cat> (385)
S9084

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Rhoifolin

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free base

>  <CAS> (385)
17306-46-6

$$$$
S9112 Kaempferitrin.cdx
csChFnd80/06042111292D

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4352

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C27H30O14

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>  <Cat> (386)
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>  <Name> (386)
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>  <Form> (386)
free base

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482-38-2

$$$$
S9120 Scutellarein.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (387)
4358

>  <Formula> (387)
C15H10O6

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>  <Name> (387)
Scutellarein

>  <CAS> (387)
529-53-3

$$$$
S9141 Berbamine.cdx
csChFnd80/06042111292D

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>  <Mol_ID> (388)
4376

>  <Formula> (388)
C37H40N2O6

>  <MolWeight> (388)
608.7233

>  <Cat> (388)
S9141

>  <Name> (388)
Berbamine

>  <Form> (388)
free base

>  <CAS> (388)
478-61-5

$$$$
S9275 Isoguanosine.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (389)
4473

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C10H13N5O5

>  <MolWeight> (389)
283.24072

>  <Cat> (389)
S9275

>  <Name> (389)
Isoguanosine

>  <Form> (389)
free base

>  <CAS> (389)
1818-71-9

$$$$

csChFnd80/06042111292D

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>  <Mol_ID> (390)
4474

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C19H21N3O2S

>  <MolWeight> (390)
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>  <Cat> (390)
S2070

>  <Name> (390)
ISCK03

>  <Synonyms> (390)
N-(4-imidazol-1-yl phenyl)sulfonamide

>  <Target> (390)
c-Kit

>  <Form> (390)
Free Base

>  <CAS> (390)
945526-43-2

>  <URL> (390)
http://www.selleck.cn/products/isck03.html

$$$$
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csChFnd80/06042111292D

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C9H6O3

>  <MolWeight> (391)
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>  <Cat> (391)
S5548

>  <Name> (391)
7-Hydroxy-4-chromone

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Src

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free base

>  <CAS> (391)
59887-89-7

>  <URL> (391)
http://selleckchem.com/products/.html

$$$$
S5617 Myristic Acid.cdx
csChFnd80/06042111292D

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4588

>  <Formula> (392)
C14H28O2

>  <MolWeight> (392)
228.37092

>  <Cat> (392)
S5617

>  <Name> (392)
Myristic Acid

>  <Form> (392)
free base

>  <CAS> (392)
544-63-8

$$$$
S5241 Lapatinib ditosylate monohydrate.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (393)
4663

>  <Formula> (393)
C43H44ClFN4O11S3

>  <MolWeight> (393)
943.4760632

>  <Cat> (393)
S5241

>  <Name> (393)
Lapatinib ditosylate monohydrate

>  <Synonyms> (393)
Tykerb Ditosylate

>  <Target> (393)
Others

>  <Form> (393)
ditosylate monohydrate

>  <CAS> (393)
388082-78-8

>  <URL> (393)
http://selleckchem.com/products/.html

$$$$
S5254 Dasatinib hydrochloride.cdx
csChFnd80/06042111292D

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M  END
>  <Mol_ID> (394)
4664

>  <Formula> (394)
C22H27Cl2N7O2S

>  <MolWeight> (394)
524.46648

>  <Cat> (394)
S5254

>  <Name> (394)
Dasatinib hydrochloride

>  <Synonyms> (394)
BMS 354825 hydrochloride

>  <Target> (394)
Abl/Src

>  <Form> (394)
hydrochloride 

>  <CAS> (394)
854001-07-3

>  <URL> (394)
http://selleckchem.com/products/.html

$$$$
S5667 Fruquintinib.cdx
csChFnd80/06042111292D

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  8  9  1  0  0  0  0
  9  5  2  0  0  0  0
  6  4  2  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
  3 10  1  0  0  0  0
  2 13  1  0  0  0  0
 12 14  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 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 16 25  2  0  0  0  0
 20 25  1  0  0  0  0
 26 27  1  0  0  0  0
 23 26  1  0  0  0  0
 28 29  1  0  0  0  0
 22 28  1  0  0  0  0
 15 19  1  0  0  0  0
  8 15  1  0  0  0  0
M  END
>  <Mol_ID> (395)
4687

>  <Formula> (395)
C21H19N3O5

>  <MolWeight> (395)
393.39266

>  <Cat> (395)
S5667

>  <Name> (395)
Fruquintinib

>  <Target> (395)
VEGFRs

>  <CAS> (395)
1194506-26-7

>  <URL> (395)
https://www.selleckchem.com/products/fruquintinib.html

$$$$

csChFnd80/06042111292D

 42 44  0  0  0  0  0  0  0  0999 V2000
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   13.9800    5.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3800    5.9375    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   15.3800    7.3375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3800    4.5375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.7800    5.9375    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
  6  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  7 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  7  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
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 16 17  2  0  0  0  0
 17 13  1  0  0  0  0
  9 18  2  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
 22  9  1  0  0  0  0
 21 23  1  0  0  0  0
 18 24  1  0  0  0  0
 24 25  1  0  0  0  0
 20 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 27 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 23 32  1  0  0  0  0
 32 33  1  0  0  0  0
 32 34  2  0  0  0  0
 33 35  2  0  0  0  0
 30 36  1  0  0  0  0
 11 37  1  0  0  0  0
 38 39  1  0  0  0  0
 39 40  2  0  0  0  0
 39 41  2  0  0  0  0
 39 42  1  0  0  0  0
M  END
>  <Mol_ID> (396)
4723

>  <Formula> (396)
C29H37N7O5S

>  <MolWeight> (396)
595.71298

>  <Cat> (396)
S5078

>  <Name> (396)
Osimertinib mesylate

>  <Synonyms> (396)
AZD9291 mesylate

>  <Target> (396)
EGFR

>  <Form> (396)
mesylate

>  <CAS> (396)
1421373-66-1

>  <URL> (396)
http://www.selleckchem.com/products/osimertinib-mesylate.html

$$$$

csChFnd80/06042111292D

 21 21  0  0  0  0  0  0  0  0999 V2000
    4.2000    3.6373    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9000    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8000    3.6373    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
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  2  0  0  0  0
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 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
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 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (397)
4744

>  <Formula> (397)
C16H21Cl2N3

>  <MolWeight> (397)
326.26404

>  <Cat> (397)
S5670

>  <Name> (397)
Chloropyramine hydrochloride

>  <Synonyms> (397)
Halopyramine hydrochloride

>  <Target> (397)
Histamine Receptor

>  <Form> (397)
hydrochloride

>  <CAS> (397)
6170-42-9

>  <URL> (397)
http://www.selleckchem.com/products/chloropyramine-hydrochloride.html

$$$$

csChFnd80/06042111292D

 28 31  0  0  0  0  0  0  0  0999 V2000
    3.6373    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  7  1  1  0  0  0  0
 15  1  2  0  0  0  0
  5  2  2  0  0  0  0
 19  2  1  0  0  0  0
  3  9  2  0  0  0  0
  4  3  1  0  0  0  0
  6  3  1  0  0  0  0
 14  4  1  0  0  0  0
 10  5  1  0  0  0  0
 13  5  1  0  0  0  0
  6 11  2  0  0  0  0
  8  6  1  0  0  0  0
 12  7  1  0  0  0  0
 21  8  1  0  0  0  0
 22  8  1  0  0  0  0
 14  8  1  0  0  0  0
  9 12  1  0  0  0  0
 18 10  1  0  0  0  0
 11 17  1  0  0  0  0
 17 12  2  0  0  0  0
 13 23  2  0  0  0  0
 16 25  2  0  0  0  0
 24 16  1  0  0  0  0
 20 18  1  0  0  0  0
 28 19  2  0  0  0  0
 26 20  1  0  0  0  0
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 23 28  1  0  0  0  0
 24 26  2  0  0  0  0
 25 27  1  0  0  0  0
M  END
>  <Mol_ID> (398)
4822

>  <Formula> (398)
C22H23N5O

>  <MolWeight> (398)
373.45092

>  <Cat> (398)
S5793

>  <Name> (398)
Motesanib (AMG-706)

>  <Synonyms> (398)
N/A

>  <Target> (398)
VEGFR

>  <Form> (398)
Free Base

>  <CAS> (398)
453562-69-1

>  <URL> (398)
http://www.selleckchem.com/products/motesanib-amg-706.html

$$$$

csChFnd80/06042111292D

 32 35  0  0  0  0  0  0  0  0999 V2000
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    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (399)
4860

>  <Formula> (399)
C25H27N5O2

>  <MolWeight> (399)
429.51418

>  <Cat> (399)
S8777

>  <Name> (399)
Evobrutinib

>  <Synonyms> (399)
M-2951, MSC-2364447C

>  <Target> (399)
BTK

>  <Form> (399)
Free Base

>  <CAS> (399)
1415823-73-2

>  <URL> (399)
http://www.selleckchem.com/products/evobrutinib.html

$$$$

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>  <Mol_ID> (400)
4878

>  <Formula> (400)
C28H32O16

>  <MolWeight> (400)
624.54408

>  <Cat> (400)
S9455

>  <Name> (400)
Isorhamnetin 3-O-neohesperoside

>  <Synonyms> (400)
N/A

>  <Target> (400)
Others

>  <Form> (400)
Free Base

>  <CAS> (400)
55033-90-4

>  <URL> (400)
http://www.selleckchem.com/products/isorhamnetin-3-o-neohesperoside.html

$$$$

csChFnd80/06042111292D

 38 43  0  0  0  0  0  0  0  0999 V2000
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>  <Formula> (401)
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>  <Cat> (401)
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>  <Synonyms> (401)
N/A

>  <Target> (401)
c-Met

>  <Form> (401)
free base

>  <CAS> (401)
1116743-46-4

>  <URL> (401)
http://www.selleck.cn/products/sar125844.html

$$$$

csChFnd80/06042111292D

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5193

>  <Formula> (402)
C14H21N5O2S

>  <MolWeight> (402)
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>  <Cat> (402)
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>  <Name> (402)
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>  <Synonyms> (402)
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>  <Target> (402)
JAK

>  <Form> (402)
free base

>  <CAS> (402)
1622902-68-4

>  <URL> (402)
http://www.selleck.cn/products/pf-04965842.html

$$$$

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c-Kit

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free base

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2248003-60-1

>  <URL> (403)
http://www.selleck.cn/products/azd3229.html

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C26H31Cl2N7O3

>  <MolWeight> (404)
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>  <Synonyms> (404)
N/A

>  <Target> (404)
FGFR

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Free Base

>  <CAS> (404)
872511-34-7

>  <URL> (404)
http://www.selleck.cn/products/bgj398-nvp-bgj398.html

$$$$

csChFnd80/06042111292D

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>  <Mol_ID> (405)
5251

>  <Formula> (405)
C30H35N7O2

>  <MolWeight> (405)
525.6446

>  <Cat> (405)
S8817

>  <Name> (405)
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>  <Synonyms> (405)
N/A

>  <Target> (405)
EGFR

>  <Form> (405)
Free Base

>  <CAS> (405)
1899921-05-1

>  <URL> (405)
http://www.selleck.cn/products/hs-10296.html

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>  <Mol_ID> (406)
5252

>  <Formula> (406)
C22H21F4N3O4

>  <MolWeight> (406)
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>  <Cat> (406)
S8821

>  <Name> (406)
GSK3179106

>  <Synonyms> (406)
N/A

>  <Target> (406)
c-RET

>  <Form> (406)
Free Base

>  <CAS> (406)
1627856-64-7

>  <URL> (406)
http://www.selleck.cn/products/gsk3179106.html

$$$$

csChFnd80/06042111292D

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M  END
>  <Mol_ID> (407)
5374

>  <Formula> (407)
C29H39ClN7O2P

>  <MolWeight> (407)
584.092421

>  <Cat> (407)
S8229

>  <Name> (407)
Brigatinib (AP26113)

>  <Synonyms> (407)
N/A

>  <Target> (407)
ALK

>  <Form> (407)
Free Base

>  <CAS> (407)
1197953-54-0

>  <URL> (407)
http://www.selleck.cn/products/brigatinib-ap26113.html

$$$$

csChFnd80/06042111292D

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M  END
>  <Mol_ID> (408)
5382

>  <Formula> (408)
C32H31N3O5S

>  <MolWeight> (408)
569.67064

>  <Cat> (408)
S8788

>  <Name> (408)
CH7057288

>  <Synonyms> (408)
N/A

>  <Target> (408)
Trk receptor

>  <Form> (408)
Free Base

>  <CAS> (408)
2095616-82-1

>  <URL> (408)
http://www.selleck.cn/products/ch7057288.html

$$$$

csChFnd80/06042111292D

 35 39  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (409)
5383

>  <Formula> (409)
C27H29N5O3

>  <MolWeight> (409)
471.55086

>  <Cat> (409)
S8791

>  <Name> (409)
Zanubrutinib (BGB-3111)

>  <Synonyms> (409)
N/A

>  <Target> (409)
BTK

>  <Form> (409)
Free Base

>  <CAS> (409)
1691249-45-2

>  <URL> (409)
http://www.selleck.cn/products/zanubrutini-bgb-3111.html

$$$$

csChFnd80/06042111292D

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    0.0000    2.3164    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
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  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
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 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
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 12 15  1  0  0  0  0
 12 16  2  0  0  0  0
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 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
 20 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 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 25  1  0  0  0  0
 27 31  1  0  0  0  0
 31 32  1  0  0  0  0
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 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 34  1  0  0  0  0
 21 37  1  0  0  0  0
M  END
>  <Mol_ID> (410)
6645

>  <Formula> (410)
C26H21F3N4O4

>  <MolWeight> (410)
510.4645496

>  <Cat> (410)
S6412

>  <Name> (410)
Altiratinib

>  <Synonyms> (410)
DCC-2701

>  <Target> (410)
Trk receptor

>  <Form> (410)
free base

>  <CAS> (410)
1345847-93-9

>  <URL> (410)
http://www.selleck.cn/products/altiratinib.html

$$$$

csChFnd80/06042111292D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
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  8  9  1  0  0  0  0
  1  9  1  0  0  0  0
  4  9  2  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
  2 10  1  0  0  0  0
 14 15  1  0  0  0  0
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 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
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 16 20  1  0  0  0  0
 13 14  1  0  0  0  0
 12 13  1  0  0  0  0
  6 21  1  0  0  0  0
M  END
>  <Mol_ID> (411)
6657

>  <Formula> (411)
C16H13FN2O2

>  <MolWeight> (411)
284.2850232

>  <Cat> (411)
S6500

>  <Name> (411)
KX1-004

>  <Synonyms> (411)
N/A

>  <Target> (411)
Src

>  <Form> (411)
free base

>  <CAS> (411)
518058-84-9

>  <URL> (411)
http://www.selleck.cn/products/kx1-004.html

$$$$

csChFnd80/06042111292D

 37 40  0  0  0  0  0  0  0  0999 V2000
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    8.4868    2.7999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2744    2.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4868    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6993    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9116    2.7999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9116    4.1999    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1240    2.0999    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3365    2.7999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5487    2.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7612    2.7999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0619    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  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  2  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  1  7  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 10 15  2  0  0  0  0
 16 17  2  0  0  0  0
 18 19  1  0  0  0  0
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 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 18 23  1  0  0  0  0
 21 24  1  0  0  0  0
 16 18  1  0  0  0  0
 13 16  1  0  0  0  0
  9 10  1  0  0  0  0
 26 27  1  6  0  0  0
 25 26  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 28 33  2  0  0  0  0
 30 34  1  0  0  0  0
 33 35  1  0  0  0  0
 29 36  1  0  0  0  0
 26 28  1  0  0  0  0
  3 25  1  0  0  0  0
  4 37  1  0  0  0  0
M  END
>  <Mol_ID> (412)
6661

>  <Formula> (412)
C25H25Cl2FN6O3

>  <MolWeight> (412)
547.4088032

>  <Cat> (412)
S6505

>  <Name> (412)
X-376

>  <Synonyms> (412)
N/A

>  <Target> (412)
ALK

>  <Form> (412)
free base

>  <CAS> (412)
1365267-27-1

>  <URL> (412)
http://www.selleck.cn/products/x-376.html

$$$$

csChFnd80/06042111292D

 38 43  0  0  0  0  0  0  0  0999 V2000
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    3.7497    4.3990    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.2864    3.9527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6486    5.3050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9341    3.5902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6587    6.2949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 33  1  0  0  0  0
  2 23  1  0  0  0  0
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  3 16  1  0  0  0  0
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  4 14  1  0  0  0  0
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  5 20  1  0  0  0  0
  6 25  1  0  0  0  0
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  7 28  2  0  0  0  0
  8 26  2  0  0  0  0
  8 34  1  0  0  0  0
  9 31  1  0  0  0  0
  9 32  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
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 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 19 21  2  0  0  0  0
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 22 24  2  0  0  0  0
 23 25  2  0  0  0  0
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 28 29  1  0  0  0  0
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 29 30  1  0  0  0  0
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 30 31  1  0  0  0  0
 30 35  2  0  0  0  0
 31 36  2  0  0  0  0
 33 34  2  0  0  0  0
 35 37  1  0  0  0  0
 36 38  1  0  0  0  0
 37 38  2  0  0  0  0
M  END
>  <Mol_ID> (413)
6669

>  <Formula> (413)
C29H34ClN7O

>  <MolWeight> (413)
532.07956

>  <Cat> (413)
S6513

>  <Name> (413)
HG-14-10-04

>  <Synonyms> (413)
N/A

>  <Target> (413)
ALK

>  <Form> (413)
free base

>  <CAS> (413)
1356962-34-9

>  <URL> (413)
http://www.selleck.cn/products/hg-14-10-04.html

$$$$

csChFnd80/06042111292D

 23 25  0  0  0  0  0  0  0  0999 V2000
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   10.9120    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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>  <URL> (416)
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 25 20  1  0  0  0  0
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 29 30  1  0  0  0  0
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 36 40  2  0  0  0  0
M  END
>  <Mol_ID> (418)
6690

>  <Formula> (418)
C28H28F3N5O4

>  <MolWeight> (418)
555.5482296

>  <Cat> (418)
S6545

>  <Name> (418)
BI-4464

>  <Synonyms> (418)
N/A

>  <Target> (418)
FAK

>  <Form> (418)
free base

>  <CAS> (418)
1227948-02-8

>  <URL> (418)
http://www.selleck.cn/products/bi-4464.html

$$$$

csChFnd80/06042111292D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 24 25  1  0  0  0  0
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  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
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  4  7  2  0  0  0  0
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 14 28  2  0  0  0  0
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M  END
>  <Mol_ID> (419)
6699

>  <Formula> (419)
C22H19N3O3

>  <MolWeight> (419)
373.40456

>  <Cat> (419)
S6567

>  <Name> (419)
Src Inhibitor 1

>  <Synonyms> (419)
N/A

>  <Target> (419)
Src

>  <Form> (419)
free base

>  <CAS> (419)
179248-59-0

>  <URL> (419)
http://www.selleck.cn/products/src-inhibitor-1.html

$$$$

csChFnd80/06042111292D

 33 38  0  0  0  0  0  0  0  0999 V2000
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  1 10  1  0  0  0  0
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 24 25  1  0  0  0  0
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 27 23  1  0  0  0  0
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 29 30  1  0  0  0  0
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 29 32  1  0  0  0  0
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M  END
>  <Mol_ID> (420)
6723

>  <Formula> (420)
C21H17N9O2S

>  <MolWeight> (420)
459.48378

>  <Cat> (420)
S8676

>  <Name> (420)
Glumetinib

>  <Synonyms> (420)
N/A

>  <Target> (420)
c-Met

>  <Form> (420)
free base

>  <CAS> (420)
1642581-63-2

>  <URL> (420)
http://www.selleck.cn/products/glumetinib.html

$$$$

csChFnd80/06042111292D

 28 32  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
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M  END
>  <Mol_ID> (421)
6731

>  <Formula> (421)
C20H12F2N6

>  <MolWeight> (421)
374.3462864

>  <Cat> (421)
S8854

>  <Name> (421)
JNJ-38877618(OMO-1)

>  <Synonyms> (421)
N/A

>  <Target> (421)
c-Met

>  <Form> (421)
free base

>  <CAS> (421)
943540-74-7

>  <URL> (421)
http://www.selleck.cn/products/jnj-38877618.html

$$$$

csChFnd80/06042111292D

 40 41  0  0  0  0  0  0  0  0999 V2000
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M  END
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6740

>  <Formula> (422)
C26H29Cl4FN6O3

>  <MolWeight> (422)
634.3572632

>  <Cat> (422)
S2934

>  <Name> (422)
Ensartinib (X-396) dihydrochloride

>  <Synonyms> (422)
N/A

>  <Target> (422)
ALK

>  <Form> (422)
Dihydrochloride

>  <CAS> (422)
2137030-98-7

>  <URL> (422)
http://www.selleck.cn/products/ensartinib-dihydrochloride.html

$$$$

csChFnd80/06042111292D

 30 32  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  1  6  2  0  0  0  0
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  3  7  1  0  0  0  0
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 17 18  2  0  0  0  0
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 21 22  1  0  0  0  0
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 23 24  1  0  0  0  0
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 27  1  1  0  0  0  0
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M  END
>  <Mol_ID> (423)
6747

>  <Formula> (423)
C21H16F3N3O3

>  <MolWeight> (423)
415.3652496

>  <Cat> (423)
S6526

>  <Name> (423)
SKLB 610

>  <Synonyms> (423)
N/A

>  <Target> (423)
VEGFR

>  <Form> (423)
Free Base

>  <CAS> (423)
1125780-41-7

>  <URL> (423)
http://www.selleck.cn/products/sklb610.html

$$$$

csChFnd80/06042111292D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  1 10  2  0  0  0  0
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 11 12  1  0  0  0  0
 13 14  1  0  0  0  0
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 15 16  1  0  0  0  0
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 17 18  1  0  0  0  0
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 11 17  1  0  0  0  0
M  END
>  <Mol_ID> (424)
6748

>  <Formula> (424)
C17H16BrN3O2

>  <MolWeight> (424)
374.23184

>  <Cat> (424)
S6530

>  <Name> (424)
EBE-A22

>  <Synonyms> (424)
N/A

>  <Target> (424)
Others

>  <Form> (424)
Free Base

>  <CAS> (424)
229476-53-3

>  <URL> (424)
http://www.selleck.cn/products/ebe-a22.html

$$$$

csChFnd80/06042111292D

 29 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (425)
6751

>  <Formula> (425)
C18H19F2N5O4

>  <MolWeight> (425)
407.3713664

>  <Cat> (425)
S6539

>  <Name> (425)
ASP5878

>  <Synonyms> (425)
N/A

>  <Target> (425)
FGFR

>  <Form> (425)
Free Base

>  <CAS> (425)
1453208-66-6

>  <URL> (425)
http://www.selleck.cn/products/asp5878.html

$$$$

csChFnd80/06042111292D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (426)
6753

>  <Formula> (426)
C16H14BrN3O2

>  <MolWeight> (426)
360.20526

>  <Cat> (426)
S6546

>  <Name> (426)
PD153035

>  <Synonyms> (426)
N/A

>  <Target> (426)
EGFR

>  <Form> (426)
Free Base

>  <CAS> (426)
153436-54-5

>  <URL> (426)
http://www.selleck.cn/products/pd153035.html

$$$$

csChFnd80/06042111292D

 28 32  0  0  0  0  0  0  0  0999 V2000
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>  <URL> (427)
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C23H20N6O

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EGFR

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1661854-97-2

>  <URL> (428)
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C22H22N6O3

>  <MolWeight> (429)
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N/A

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FGFR

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Free Base

>  <CAS> (429)
1448169-71-8

>  <URL> (429)
http://www.selleck.cn/products/tas-120.html

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>  <CAS> (430)
1303420-67-8

>  <URL> (430)
http://www.selleck.cn/products/plx5622.html

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N/A

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ROS

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Free Base

>  <CAS> (431)
1505515-69-4

>  <URL> (431)
http://www.selleck.cn/products/ds-6051b.html

$$$$

csChFnd80/06042111292D

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M  END
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6873

>  <Formula> (432)
C23H21N3O2

>  <MolWeight> (432)
371.43174

>  <Cat> (432)
S2212

>  <Name> (432)
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>  <Synonyms> (432)
N/A

>  <Target> (432)
ACK

>  <Form> (432)
Free Base

>  <CAS> (432)
873305-35-2

>  <URL> (432)
http://www.selleck.cn/products/aim-100.html

$$$$

csChFnd80/06042111292D

 23 25  0  0  0  0  0  0  0  0999 V2000
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6878

>  <Formula> (433)
C18H18N2O3

>  <MolWeight> (433)
310.34712

>  <Cat> (433)
S6514

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SU5408

>  <Synonyms> (433)
VEGFR2 Kinase Inhibitor I 

>  <Target> (433)
VEGFR

>  <Form> (433)
Free Base

>  <CAS> (433)
15966-93-5

>  <URL> (433)
http://www.selleck.cn/products/su5408.html

$$$$

csChFnd80/06042111292D

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>  <Formula> (434)
C26H30F3N7O2

>  <MolWeight> (434)
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>  <Cat> (434)
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>  <Name> (434)
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>  <Synonyms> (434)
N/A

>  <Target> (434)
FLT3

>  <Form> (434)
Free Base

>  <CAS> (434)
630124-46-8

>  <URL> (434)
http://www.selleck.cn/products/ast-487.html

$$$$

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   13.1309    6.3909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5011    6.6784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.9372    8.0087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 20 22  2  0  0  0  0
 20 24  1  0  0  0  0
 21 28  2  0  0  0  0
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 31 35  2  0  0  0  0
 32 35  1  0  0  0  0
M  END
>  <Mol_ID> (435)
6911

>  <Formula> (435)
C26H21F2N5O2S

>  <MolWeight> (435)
505.5390464

>  <Cat> (435)
S8882

>  <Name> (435)
ODM-203

>  <Synonyms> (435)
N/A

>  <Target> (435)
FGFR

>  <Form> (435)
Free Base

>  <CAS> (435)
1430723-35-5

>  <URL> (435)
http://www.selleck.cn/products/odm-203.html

$$$$

csChFnd80/06042111292D

 39 43  0  0  0  0  0  0  0  0999 V2000
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   12.1240    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
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  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
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  2  7  2  0  0  0  0
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 10 11  1  0  0  0  0
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 12 16  1  0  0  0  0
  9 10  1  0  0  0  0
 20 21  1  0  0  0  0
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 31 32  1  0  0  0  0
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 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
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 32 35  1  0  0  0  0
 30 31  1  0  0  0  0
 21 30  1  0  0  0  0
  4 26  1  0  0  0  0
  5 39  1  0  0  0  0
M  END
>  <Mol_ID> (436)
6930

>  <Formula> (436)
C29H28F3N5O2

>  <MolWeight> (436)
535.5601296

>  <Cat> (436)
S2213

>  <Name> (436)
AMG-47a

>  <Synonyms> (436)
N/A

>  <Target> (436)
Src

>  <Form> (436)
Free Base

>  <CAS> (436)
882663-88-9

>  <URL> (436)
http://www.selleck.cn/products/.html

$$$$

csChFnd80/06042111292D

 42 47  0  0  0  0  0  0  0  0999 V2000
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    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.9000    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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 29 30  2  0  0  0  0
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M  END
>  <Mol_ID> (437)
6969

>  <Formula> (437)
C32H26N4O6

>  <MolWeight> (437)
562.57204

>  <Cat> (437)
S8933

>  <Name> (437)
ONO-7475

>  <Synonyms> (437)
N/A

>  <Target> (437)
TAM Receptor

>  <Form> (437)
Free Base

>  <CAS> (437)
1646839-59-9

>  <URL> (437)
http://www.selleckchem.com/products/ono-7475.html

$$$$

csChFnd80/06042111292D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  2  5  2  0  0  0  0
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  3  7  1  0  0  0  0
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  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5  9  1  0  0  0  0
  6 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  2  0  0  0  0
  7 14  1  0  0  0  0
  8 15  1  0  0  0  0
  9 16  1  0  0  0  0
 10 17  2  0  0  0  0
 11 17  1  0  0  0  0
 13 18  1  0  0  0  0
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 14 20  2  0  0  0  0
 15 18  2  0  0  0  0
 19 21  2  0  0  0  0
 20 21  1  0  0  0  0
 16 22  1  0  0  0  0
 16 23  1  0  0  0  0
 16 24  1  0  0  0  0
M  END
>  <Mol_ID> (438)
6983

>  <Formula> (438)
C19H19N5

>  <MolWeight> (438)
317.38766

>  <Cat> (438)
S2642

>  <Name> (438)
1-Naphthyl PP1(1-NA-PP1)

>  <Synonyms> (438)
N/A

>  <Target> (438)
Src

>  <Form> (438)
Free Base

>  <CAS> (438)
221243-82-9

>  <URL> (438)
http://www.selleckchem.com/products/1-na-pp1.html

$$$$

csChFnd80/06042111292D

 18 20  0  0  0  0  0  0  0  0999 V2000
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  1 18  1  0  0  0  0
  2  7  2  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
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  5  7  1  0  0  0  0
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  6 10  2  0  0  0  0
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 10 13  1  0  0  0  0
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 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (439)
7014

>  <Formula> (439)
C15H10FNO

>  <MolWeight> (439)
239.2444032

>  <Cat> (439)
S6808

>  <Name> (439)
SU5205

>  <Synonyms> (439)
N/A

>  <Target> (439)
VEGFR

>  <Form> (439)
Free Base

>  <CAS> (439)
3476-86-6

>  <URL> (439)
http://www.selleckchem.com/products/su-5205.html

$$$$

csChFnd80/06042111292D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  2 19  1  0  0  0  0
  3  6  1  0  0  0  0
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  4  6  1  0  0  0  0
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M  END
>  <Mol_ID> (440)
7015

>  <Formula> (440)
C16H13NO2

>  <MolWeight> (440)
251.27992

>  <Cat> (440)
S6809

>  <Name> (440)
SU5214

>  <Synonyms> (440)
N/A

>  <Target> (440)
EGFR

>  <Form> (440)
Free Base

>  <CAS> (440)
186611-04-1

>  <URL> (440)
http://www.selleckchem.com/products/su-5214.html

$$$$

csChFnd80/06042111292D

 43 46  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (441)
7016

>  <Formula> (441)
C32H39N7O4

>  <MolWeight> (441)
585.69656

>  <Cat> (441)
S6813

>  <Name> (441)
Mobocertinib (TAK788)

>  <Synonyms> (441)
AP32788

>  <Target> (441)
EGFR

>  <Form> (441)
Free Base

>  <CAS> (441)
1847461-43-1

>  <URL> (441)
http://www.selleckchem.com/products/tak788.html

$$$$

csChFnd80/06042111292D

 61 66  0  0  0  0  0  0  0  0999 V2000
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 33 34  2  0  0  0  0
 33 35  1  0  0  0  0
 34 37  1  0  0  0  0
 35 38  2  0  0  0  0
 36 40  1  0  0  0  0
 37 39  2  0  0  0  0
 38 39  1  0  0  0  0
 39 41  1  0  0  0  0
 41 42  2  0  0  0  0
 42 43  1  0  0  0  0
 44 46  2  0  0  0  0
 44 47  1  0  0  0  0
 46 48  1  0  0  0  0
 47 49  2  0  0  0  0
 48 50  2  0  0  0  0
 49 50  1  0  0  0  0
 50 51  1  0  0  0  0
 51 52  2  0  0  0  0
 52 53  1  0  0  0  0
 55 56  2  0  0  0  0
 55 57  1  0  0  0  0
 56 58  1  0  0  0  0
 57 59  2  0  0  0  0
 58 60  2  0  0  0  0
 59 60  1  0  0  0  0
M  END
>  <Mol_ID> (442)
7029

>  <Formula> (442)
C43H46F3N7O7S

>  <MolWeight> (442)
861.9282496

>  <Cat> (442)
S8888

>  <Name> (442)
GMB-475

>  <Synonyms> (442)
N/A

>  <Target> (442)
PROTAC

>  <Form> (442)
Free Base

>  <CAS> (442)
no cas

>  <URL> (442)
http://www.selleckchem.com/products/gmb-475.html

$$$$

csChFnd80/06042111292D

 30 33  0  0  0  0  0  0  0  0999 V2000
    0.5124    2.4249    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.5124    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.9124    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   14.5495    7.5126    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371    5.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873    5.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    5.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748    7.5126    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    7.5126    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7619    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4620    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1620    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5495    6.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9121    8.2126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6997    7.5126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748    6.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    4.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    6.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    3.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    8.2126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 29  1  0  0  0  0
  2 29  1  0  0  0  0
  3 29  1  0  0  0  0
  4 13  2  0  0  0  0
  5 13  1  0  0  0  0
  5 14  1  0  0  0  0
  6 17  1  0  0  0  0
  6 20  1  0  0  0  0
  7 21  1  0  0  0  0
  7 23  1  0  0  0  0
  8 20  2  0  0  0  0
  8 30  1  0  0  0  0
  9 23  1  0  0  0  0
  9 30  2  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 12  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 19  2  0  0  0  0
 20 22  1  0  0  0  0
 21 25  1  0  0  0  0
 21 26  2  0  0  0  0
 22 23  2  0  0  0  0
 24 25  2  0  0  0  0
 24 27  1  0  0  0  0
 24 29  1  0  0  0  0
 26 28  1  0  0  0  0
 27 28  2  0  0  0  0
M  END
>  <Mol_ID> (443)
7054

>  <Formula> (443)
C21H18F3N5O

>  <MolWeight> (443)
413.3957296

>  <Cat> (443)
S0360

>  <Name> (443)
EGFR?Inhibitor

>  <Synonyms> (443)
N/A

>  <Target> (443)
EGFR

>  <Form> (443)
Free Base

>  <CAS> (443)
879127-07-8

>  <URL> (443)
http://www.selleckchem.com/products/egfr-inhibitor.html

$$$$

csChFnd80/06042111292D

 34 37  0  0  0  0  0  0  0  0999 V2000
    3.6374    4.9001    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.3374    3.6877    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9374    6.1125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6997   14.0003    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2001    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.6618   11.4737    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748    9.8002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873   11.9002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623   11.9002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    5.6001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8001    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
    4.8498    7.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    7.7002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371   13.3003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371   11.9002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    7.7002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    9.1002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4789   12.6003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6618   13.7269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1247   14.0003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    9.1002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    9.8002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1247   11.2002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9121   13.3003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9121   11.9002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8789   12.6003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748   11.2002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873   13.3003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748   14.0003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623   13.3003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  1 11  1  0  0  0  0
  4 28  1  0  0  0  0
  4 32  1  0  0  0  0
  5 12  1  0  0  0  0
  6 13  1  0  0  0  0
  6 23  1  0  0  0  0
  6 24  1  0  0  0  0
  7 17  1  0  0  0  0
  7 20  1  0  0  0  0
  8 19  1  0  0  0  0
  8 31  1  0  0  0  0
  9 31  1  0  0  0  0
  9 32  2  0  0  0  0
 10 31  2  0  0  0  0
 10 34  1  0  0  0  0
 11 14  1  0  0  0  0
 12 13  1  0  0  0  0
 14 15  2  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 16 17  2  0  0  0  0
 16 21  1  0  0  0  0
 16 22  1  0  0  0  0
 17 27  1  0  0  0  0
 18 25  2  0  0  0  0
 19 26  2  0  0  0  0
 20 21  2  0  0  0  0
 20 30  1  0  0  0  0
 22 28  2  0  0  0  0
 25 26  1  0  0  0  0
 27 29  2  0  0  0  0
 28 29  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
M  END
>  <Mol_ID> (444)
7063

>  <Formula> (444)
C24H28N6O3S

>  <MolWeight> (444)
480.58252

>  <Cat> (444)
S0487

>  <Name> (444)
Sulfatinib

>  <Synonyms> (444)
HMPL-012, Sufatinib, Surfatinib

>  <Target> (444)
CSF-1R

>  <Form> (444)
Free Base

>  <CAS> (444)
1308672-74-3

>  <URL> (444)
http://www.selleckchem.com/products/sulfatinib.html

$$$$

csChFnd80/06042111292D

 32 35  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.8000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   16.2453    7.4353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2390    7.6463    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1791    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9405    8.1887    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.0381    6.0206    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7454    9.8082    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8056    3.2076    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9621    0.2734    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.9767    7.0594    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.6880    8.4293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3689    6.9107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9017    9.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3104    8.4774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6692    6.3141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7306    5.2754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3386    5.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0193    3.9055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7670    4.1461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6407    6.6377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3970    3.8573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1153   10.0969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8103   10.8502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2974    3.3337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9621    2.5266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7791    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 31  1  0  0  0  0
  2 14  2  0  0  0  0
  3 15  2  0  0  0  0
  4 28  2  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  5 14  1  0  0  0  0
 10  6  1  1  0  0  0
  6 15  1  0  0  0  0
  7 14  1  0  0  0  0
  7 22  1  0  0  0  0
  7 23  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
  9 27  1  0  0  0  0
  9 28  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 17 20  1  0  0  0  0
 18 24  1  0  0  0  0
 19 21  1  0  0  0  0
 21 25  2  0  0  0  0
 25 26  1  0  0  0  0
 25 28  1  0  0  0  0
 26 27  2  0  0  0  0
 26 29  1  0  0  0  0
 27 30  1  0  0  0  0
 29 31  2  0  0  0  0
 30 32  2  0  0  0  0
 31 32  1  0  0  0  0
M  END
>  <Mol_ID> (445)
7092

>  <Formula> (445)
C23H26FN5O3

>  <MolWeight> (445)
439.4826432

>  <Cat> (445)
S6843

>  <Name> (445)
Vorolanib

>  <Synonyms> (445)
CM082

>  <Target> (445)
VEGFR

>  <Form> (445)
Free Base

>  <CAS> (445)
1013920-15-4

>  <URL> (445)
http://www.selleckchem.com/products/vorolanib.html

$$$$

csChFnd80/06042111292D

 34 37  0  0  0  0  0  0  0  0999 V2000
   14.6894    9.8242    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.8767    5.6365    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3348    6.3392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5431    8.4319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2083    2.0928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0588   10.1155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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213743-31-8

>  <URL> (447)
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>  <URL> (448)
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 36 44  1  0  0  0  0
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M  END
>  <Mol_ID> (449)
7116

>  <Formula> (449)
C45H52ClN9O8S

>  <MolWeight> (449)
914.46788

>  <Cat> (449)
S0072

>  <Name> (449)
MS4078

>  <Target> (449)
ALK

>  <Form> (449)
free base

>  <CAS> (449)
2229036-62-6

>  <URL> (449)
http://www.selleckchem.com/products/ms4078.html

$$$$

csChFnd80/06042111292D

 35 39  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
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 20 21  1  0  0  0  0
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 25 16  1  0  0  0  0
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 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 25  1  0  0  0  0
 27 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
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M  END
>  <Mol_ID> (450)
7120

>  <Formula> (450)
C24H27F2N5O4

>  <MolWeight> (450)
487.4990864

>  <Cat> (450)
S0088

>  <Name> (450)
Pemigatinib (INCB054828)

>  <Target> (450)
FGFR

>  <Form> (450)
free base

>  <CAS> (450)
1513857-77-6

>  <URL> (450)
http://www.selleckchem.com/products/pemigatinib-incb054828.html

$$$$

csChFnd80/06042111292D

 19 21  0  0  0  0  0  0  0  0999 V2000
    1.2082    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  1 10  1  0  0  0  0
  8 11  2  0  0  0  0
  9 12  2  0  0  0  0
 12 13  1  0  0  0  0
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 17 19  1  0  0  0  0
M  END
>  <Mol_ID> (451)
7143

>  <Formula> (451)
C15H13ClN2O

>  <MolWeight> (451)
272.72952

>  <Cat> (451)
S0278

>  <Name> (451)
SU5614

>  <Target> (451)
VEGFR

>  <Form> (451)
free base

>  <CAS> (451)
1055412-47-9

>  <URL> (451)
http://www.selleckchem.com/products/su5614.html

$$$$

csChFnd80/06042111292D

 25 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (452)
7153

>  <Formula> (452)
C15H17ClN6O3

>  <MolWeight> (452)
364.78688

>  <Cat> (452)
S0377

>  <Name> (452)
CS-2660 (JNJ-38158471)

>  <Target> (452)
VEGFR

>  <Form> (452)
free base

>  <CAS> (452)
951151-97-6

>  <URL> (452)
http://www.selleckchem.com/products/jnj-38158471.html

$$$$

csChFnd80/06042111292D

 22 24  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  9  1  0  0  0  0
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  8  9  1  0  0  0  0
 10 13  2  0  0  0  0
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 11 13  1  0  0  0  0
 13 17  1  0  0  0  0
 16 19  2  0  0  0  0
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 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (453)
7209

>  <Formula> (453)
C20H28O2

>  <MolWeight> (453)
300.43512

>  <Cat> (453)
S3226

>  <Name> (453)
Dehydroabietic acid

>  <Target> (453)
Anti-infection

>  <Form> (453)
free base

>  <CAS> (453)
1740-19-8

>  <URL> (453)
http://www.selleckchem.com/products/dehydroabietic-acid.html

$$$$

csChFnd80/06042111292D

 34 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (454)
7285

>  <Formula> (454)
C27H33ClN2O4

>  <MolWeight> (454)
485.01492

>  <Cat> (454)
S6760

>  <Name> (454)
LM22B-10

>  <Target> (454)
Trk receptor

>  <Form> (454)
free base

>  <CAS> (454)
342777-54-2

>  <URL> (454)
http://www.selleckchem.com/products/lm2b-10.html

$$$$

csChFnd80/06042111292D

 31 36  0  0  0  0  0  0  0  0999 V2000
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   12.2900    0.6421    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2791    6.5694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 23  2  0  0  0  0
 11 27  2  0  0  0  0
 12 13  1  0  0  0  0
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 13 14  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
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 20 24  2  0  0  0  0
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 22 28  1  0  0  0  0
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M  END
>  <Mol_ID> (455)
7286

>  <Formula> (455)
C20H15F3N8

>  <MolWeight> (455)
424.3819096

>  <Cat> (455)
S6762

>  <Name> (455)
Bozitinib (PLB-1001)

>  <Target> (455)
c-Met

>  <Form> (455)
free base

>  <CAS> (455)
1440964-89-5

>  <URL> (455)
http://www.selleckchem.com/products/bozitinib.html

$$$$

csChFnd80/06042111292D

 46 48  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (456)
7300

>  <Formula> (456)
C29H35F3N8O5S

>  <MolWeight> (456)
664.6990096

>  <Cat> (456)
S6868

>  <Name> (456)
Alflutinib (AST2818) mesylate

>  <Target> (456)
EGFR

>  <Form> (456)
mesylate

>  <CAS> (456)
1869057-83-9

>  <URL> (456)
http://www.selleckchem.com/products/alflutinib-ast2818-.html

$$$$

csChFnd80/06042111292D

 41 45  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (457)
7301

>  <Formula> (457)
C31H29FN4O5

>  <MolWeight> (457)
556.5841632

>  <Cat> (457)
S6870

>  <Name> (457)
Ningetinib

>  <Target> (457)
c-Met

>  <Form> (457)
free base

>  <CAS> (457)
1394820-69-9

>  <URL> (457)
http://www.selleckchem.com/products/ningetinib.html

$$$$

csChFnd80/06042111292D

 26 29  0  0  0  0  0  0  0  0999 V2000
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    4.1770    1.8457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7464    3.1246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7794    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.6291    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  3  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13  9  2  0  0  0  0
 11 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  2  0  0  0  0
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 20 15  1  0  0  0  0
 17 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
M  END
>  <Mol_ID> (458)
7343

>  <Formula> (458)
C18H19N5O3

>  <MolWeight> (458)
353.37516

>  <Cat> (458)
S8965

>  <Name> (458)
BO-264

>  <Target> (458)
TACC3

>  <Form> (458)
free base

>  <CAS> (458)
2408648-20-2

>  <URL> (458)
http://www.selleckchem.com/products/bo-264.html

$$$$

csChFnd80/06042111292D

 32 35  0  0  0  0  0  0  0  0999 V2000
    4.8371    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2620    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2620    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2620   10.4854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4744   11.1854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4744   12.5854    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2620   13.2854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496   12.5854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827   13.2830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8909   12.5854    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827   14.6781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8909   15.3757    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
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13  8  1  0  0  0  0
 11 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  2  0  0  0  0
 18 19  1  0  0  0  0
 19 14  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 16 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 23  1  0  0  0  0
 26 29  1  0  0  0  0
 29 30  2  0  0  0  0
 29 31  1  0  0  0  0
 31 32  2  0  0  0  0
M  END
>  <Mol_ID> (459)
7352

>  <Formula> (459)
C26H25N3O3

>  <MolWeight> (459)
427.495

>  <Cat> (459)
S9600

>  <Name> (459)
Orelabrutinib

>  <Target> (459)
BTK

>  <Form> (459)
free base

>  <CAS> (459)
1655504-04-3

>  <URL> (459)
http://www.selleckchem.com/products/orelabrutinib.html

$$$$

csChFnd80/06042111292D

 35 37  0  0  0  0  0  0  0  0999 V2000
    2.4147    3.4906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4147    2.0905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6273    1.3907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8398    3.4906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2065    4.1884    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    6.0481    1.3930    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2065    1.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8980    1.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8980    4.1930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6855    3.4929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3228    4.1930    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5354    3.4929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7478    4.1930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9602    3.4929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   20.5975    4.1930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   20.5974    5.5907    0.0000 H   1  0  0  0  0  0  0  0  0  0  0  0
   21.8059    4.8907    0.0000 H   1  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    0.6966    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  1  7  1  0  0  0  0
  4  8  1  0  0  0  0
  2  9  1  0  0  0  0
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 13 14  1  0  0  0  0
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 18 13  2  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
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 21 22  1  0  0  0  0
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 25 20  1  0  0  0  0
 22 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  2  0  0  0  0
 27 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 29 32  1  0  0  0  0
  9 33  1  0  0  0  0
  9 34  1  0  0  0  0
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M  ISO  1  30   2
M  ISO  1  31   2
M  ISO  1  32   2
M  END
>  <Mol_ID> (460)
7358

>  <Formula> (460)
C21H13ClD3F3N4O3

>  <MolWeight> (460)
467.843434934

>  <Cat> (460)
S9621

>  <Name> (460)
Donafenib (Sorafenib D3)

>  <Target> (460)
Raf

>  <Form> (460)
free base

>  <CAS> (460)
1130115-44-4

>  <URL> (460)
http://www.selleckchem.com/products/donafenib-sorafenib-d3.html

$$$$

csChFnd80/06042111292D

 37 40  0  0  0  0  0  0  0  0999 V2000
    6.2497    9.1000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.3119    7.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.2497    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3119    2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1617    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.7368    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 28  1  0  0  0  0
  3 20  2  0  0  0  0
  4 29  1  0  0  0  0
  4 30  1  0  0  0  0
  5 35  2  0  0  0  0
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  7 25  1  0  0  0  0
  7 33  2  0  0  0  0
  8 31  1  0  0  0  0
  8 34  1  0  0  0  0
  8 35  1  0  0  0  0
  9 32  2  0  0  0  0
  9 33  1  0  0  0  0
 10 32  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
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 14 15  2  0  0  0  0
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 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
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 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 21 22  1  0  0  0  0
 21 24  2  0  0  0  0
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 22 27  1  0  0  0  0
 23 25  1  0  0  0  0
 23 26  1  0  0  0  0
 24 28  1  0  0  0  0
 25 29  2  0  0  0  0
 26 28  2  0  0  0  0
 29 32  1  0  0  0  0
 30 31  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  2  0  0  0  0
M  END
>  <Mol_ID> (461)
7365

>  <Formula> (461)
C27H27F2N5O3

>  <MolWeight> (461)
507.5317864

>  <Cat> (461)
S9660

>  <Name> (461)
Remibrutinib (LOU064)

>  <Target> (461)
BTK

>  <Form> (461)
free base

>  <CAS> (461)
1787294-07-8

>  <URL> (461)
http://www.selleckchem.com/products/remibrutinib-lou064.html

$$$$

csChFnd80/06042111292D

 35 39  0  0  0  0  0  0  0  0999 V2000
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    6.0412    5.7494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2537    5.0494    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4661    5.7494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4661    7.1494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2537    7.8494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7977    5.3168    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.6206    6.4494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7977    7.5820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8330    5.0518    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6248    5.7494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    5.0518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.5252    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  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
  2 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
 15  7  1  1  0  0  0
  9 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
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 21 16  1  0  0  0  0
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 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
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 15 30  1  0  0  0  0
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 31 32  1  0  0  0  0
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 33 34  1  0  0  0  0
 34 15  1  0  0  0  0
 32 35  1  6  0  0  0
M  END
>  <Mol_ID> (462)
7366

>  <Formula> (462)
C28H40N6O

>  <MolWeight> (462)
476.6568

>  <Cat> (462)
S9662

>  <Name> (462)
UNC2025

>  <Target> (462)
FLT3

>  <Form> (462)
free base

>  <CAS> (462)
1429881-91-3

>  <URL> (462)
http://www.selleckchem.com/products/unc2025.html

$$$$

csChFnd80/06042111292D

 35 42  0  0  0  0  0  0  0  0999 V2000
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    4.1018    7.5798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6140    7.4308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5260    8.3118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  1  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  2  0  0  0  0
 11  7  1  0  0  0  0
 10 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 11  1  0  0  0  0
  8 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19  9  2  0  0  0  0
  9 10  1  0  0  0  0
  7  8  1  0  0  0  0
 16 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 17  1  0  0  0  0
  5 20  1  0  0  0  0
 21 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 22  2  0  0  0  0
 18 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 19  1  0  0  0  0
 27 30  2  0  0  0  0
  1 31  1  6  0  0  0
  2 32  1  1  0  0  0
  3 34  1  1  0  0  0
 32 33  1  0  0  0  0
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M  END
>  <Mol_ID> (463)
7372

>  <Formula> (463)
C28H26N4O3

>  <MolWeight> (463)
466.53104

>  <Cat> (463)
S1421

>  <Name> (463)
Staurosporine

>  <Synonyms> (463)
CGP 41251

>  <Target> (463)
PKC,ADC Cytotoxin,PKA,S6 Kinase,CaMK,PKG i

>  <Form> (463)
Free Base

>  <CAS> (463)
62996-74-1

>  <URL> (463)
https://www.selleckchem.com/products/Staurosporine.html

$$$$

csChFnd80/06042111292D

 46 45  0  0  0  0  0  0  0  0999 V2000
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    3.6458    4.2024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4333    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6500    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8624    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0748    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.7164    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9288    1.4024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1412    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3537    1.4024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   24.2656    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4780    1.4024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6905    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9288    0.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
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 29 30  2  0  0  0  0
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 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 34 35  1  0  0  0  0
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 38 40  1  0  0  0  0
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 18 45  1  0  0  0  0
 14 46  1  0  0  0  0
M  END
>  <Mol_ID> (464)
7374

>  <Formula> (464)
C45H74O

>  <MolWeight> (464)
631.06846

>  <Cat> (464)
S2360

>  <Name> (464)
Solanesol (Nonaisoprenol)

>  <Synonyms> (464)
Nonaisoprenol, Betulanonaprenol

>  <Target> (464)
others

>  <Form> (464)
Free Base

>  <CAS> (464)
13190-97-1

>  <URL> (464)
https://www.selleckchem.com/products/solanesol-nonaisoprenol.html

$$$$

csChFnd80/06042111292D

 24 27  0  0  0  0  0  0  0  0999 V2000
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    4.9450    2.3193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7326    3.0193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.5208    2.1331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.0902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.5484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9450    9.3193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5202    9.3193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0208    4.5059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9558    3.4638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 14  2  0  0  0  0
  2  7  1  0  0  0  0
  2 21  1  0  0  0  0
  2 22  1  0  0  0  0
  3 11  1  0  0  0  0
  3 14  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4 15  2  0  0  0  0
  5 10  1  0  0  0  0
  5 12  2  0  0  0  0
  6  7  1  0  0  0  0
  6 16  2  0  0  0  0
  7 13  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  8 14  1  0  0  0  0
  9 11  1  0  0  0  0
  9 17  2  0  0  0  0
 11 18  2  0  0  0  0
 12 13  1  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 23  1  0  0  0  0
 18 24  1  0  0  0  0
 19 20  2  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (465)
7398

>  <Formula> (465)
C21H18N2O

>  <MolWeight> (465)
314.38042

>  <Cat> (465)
S0765

>  <Name> (465)
MAZ51

>  <Synonyms> (465)
N/A

>  <Target> (465)
VEGFR. Akt. GSK-3. Rho. apoptosis related

>  <Form> (465)
Free Base

>  <CAS> (465)
163655-37-6

>  <URL> (465)
https://www.selleckchem.com/products/maz51.html

$$$$

csChFnd80/06042111292D

 22 24  0  0  0  0  0  0  0  0999 V2000
    8.4973    0.0000    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    5.6386    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    8.4338    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0848    4.1927    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0928    8.4848    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3614    6.3071    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8414    6.3362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8414    7.7362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0848    5.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6290    5.6362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4164    6.3362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6290    8.4362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4164    7.7362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2869    3.4986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3614    7.7653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2848    2.0952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4973    4.1952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4973    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7097    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7097    2.0952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.3362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.7362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 18  1  0  0  0  0
  2 11  1  0  0  0  0
  2 21  1  0  0  0  0
  3 13  1  0  0  0  0
  3 22  1  0  0  0  0
  4  9  1  0  0  0  0
  4 14  1  0  0  0  0
  5  8  1  0  0  0  0
  5 15  2  0  0  0  0
  6  9  2  0  0  0  0
  6 15  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  2  0  0  0  0
  8 12  2  0  0  0  0
 10 11  1  0  0  0  0
 11 13  2  0  0  0  0
 12 13  1  0  0  0  0
 14 16  2  0  0  0  0
 14 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (466)
7473

>  <Formula> (466)
C16H14IN3O2

>  <MolWeight> (466)
407.20573

>  <Cat> (466)
S0151

>  <Name> (466)
AG-1557

>  <Synonyms> (466)
N/A

>  <Target> (466)
EGFR

>  <Form> (466)
Free Base

>  <CAS> (466)
189290-58-2

>  <URL> (466)
https://www.selleckchem.com/products/ag-1557.html

$$$$

csChFnd80/06042111292D

 24 27  0  0  0  0  0  0  0  0999 V2000
    6.0496    5.8224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    4.4224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2620    3.7224    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4744    4.4224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4744    5.8224    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2620    6.5224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8059    3.9898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6288    5.1224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8059    6.2551    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2620    7.9176    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.2370    2.6630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    6.5200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    7.9200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.1023    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0391    1.0404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6064    2.3719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    5.8224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.5200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  2  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
  7 11  1  0  0  0  0
  1 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
 11 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 11  1  0  0  0  0
 16 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (467)
7486

>  <Formula> (467)
C18H15N5O

>  <MolWeight> (467)
317.3446

>  <Cat> (467)
S0256

>  <Name> (467)
Ehp-inhibitor-1

>  <Synonyms> (467)
Ehp inhibitor 2

>  <Target> (467)
Ephrin receptor

>  <Form> (467)
Free Base

>  <CAS> (467)
861249-59-4

>  <URL> (467)
https://www.selleckchem.com/products/ehp-inhibitor.html

$$$$

csChFnd80/06042111292D

 20 22  0  0  0  0  0  0  0  0999 V2000
    5.0545    6.5190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9668    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7497    0.2734    0.0000 N   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
    3.7497    2.5266    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
    4.5668    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1846    3.8575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5545    4.1462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9895    5.4769    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
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4896    3.1041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3594    5.7656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8595    3.3928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2943    4.7236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4894    7.8497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8593    8.1384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  1  0  0  0  0
  1 19  1  0  0  0  0
  2  7  2  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4 10  2  0  0  0  0
  5  7  1  0  0  0  0
  6 11  2  0  0  0  0
  8  9  1  0  0  0  0
  9 12  1  0  0  0  0
  9 15  2  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 16  2  0  0  0  0
 13 14  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 18  2  0  0  0  0
 19 20  1  0  0  0  0
  8  5  2  0  0  0  0
M  END
>  <Mol_ID> (468)
7492

>  <Formula> (468)
C17H15NO2

>  <MolWeight> (468)
265.3065

>  <Cat> (468)
S0290

>  <Name> (468)
SU5204

>  <Synonyms> (468)
N/A

>  <Target> (468)
VEGFR. HER2

>  <Form> (468)
Free Base

>  <CAS> (468)
186611-11-0

>  <URL> (468)
https://www.selleckchem.com/products/su5204.html

$$$$

csChFnd80/06042111292D

 41 45  0  0  0  0  0  0  0  0999 V2000
    8.5821    2.8486    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   16.9665    6.9153    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3254   11.4776    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7947    9.1486    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1573    4.2486    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2152    0.0147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4353    9.6195    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.7353   10.8319    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.0071    7.0486    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1573    0.0486    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.8276    9.4732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3969    8.1942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4984    8.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2195    9.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3658   10.5409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6760    8.7637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1180    7.6248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3046   12.1110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7896    7.2097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0071    8.4486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6969   12.2573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4817   13.2436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2665   13.5362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0512   14.5225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4435   14.6689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.5821    7.0486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3697    4.9486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5821    4.2486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3697    6.3486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9448    2.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1573    2.8486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9448    0.7486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6933    2.8972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3697    2.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6933    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.7195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    2.1777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3697    0.7486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 30  1  0  0  0  0
  2 12  1  0  0  0  0
  3 15  2  0  0  0  0
  4 20  2  0  0  0  0
  5 29  1  0  0  0  0
  5 33  1  0  0  0  0
  6 38  1  0  0  0  0
  6 41  1  0  0  0  0
  7  8  1  0  0  0  0
  7 11  1  0  0  0  0
  7 13  1  0  0  0  0
  8 15  1  0  0  0  0
  8 18  1  0  0  0  0
  9 20  1  0  0  0  0
  9 26  1  0  0  0  0
 10 34  2  0  0  0  0
 10 40  1  0  0  0  0
 11 12  1  0  0  0  0
 12 16  1  0  0  0  0
 12 17  1  0  0  0  0
 13 14  2  0  0  0  0
 13 19  1  0  0  0  0
 14 15  1  0  0  0  0
 14 20  1  0  0  0  0
 18 21  2  0  0  0  0
 18 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 25  2  0  0  0  0
 24 25  1  0  0  0  0
 26 27  2  0  0  0  0
 26 28  1  0  0  0  0
 27 30  1  0  0  0  0
 28 31  2  0  0  0  0
 29 30  2  0  0  0  0
 29 31  1  0  0  0  0
 32 33  2  0  0  0  0
 32 34  1  0  0  0  0
 32 35  1  0  0  0  0
 33 36  1  0  0  0  0
 34 37  1  0  0  0  0
 35 39  2  0  0  0  0
 36 40  2  0  0  0  0
 37 38  2  0  0  0  0
 38 39  1  0  0  0  0
M  END
>  <Mol_ID> (469)
7500

>  <Formula> (469)
C31H29FN4O5

>  <MolWeight> (469)
556.5841632

>  <Cat> (469)
S0361

>  <Name> (469)
AMG-1

>  <Synonyms> (469)
c-Met/RON Dual Kinase Inhibitor, RON-IN-1

>  <Target> (469)
c-Met

>  <Form> (469)
Free Base

>  <CAS> (469)
913376-84-8

>  <URL> (469)
https://www.selleckchem.com/products/amg-1.html

$$$$

csChFnd80/06042111292D

 23 25  0  0  0  0  0  0  0  0999 V2000
    2.4249    2.4990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.8330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8677    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.3726    0.1330    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.5851    0.8330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7975    0.1330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0099    0.8330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0099    2.2330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7975    2.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5851    2.2330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3726    2.9330    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  4  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
 12 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
 13 23  1  0  0  0  0
M  END
>  <Mol_ID> (470)
7501

>  <Formula> (470)
C17H16FN5

>  <MolWeight> (470)
309.3408432

>  <Cat> (470)
S0373

>  <Name> (470)
CZC-8004

>  <Synonyms> (470)
CZC-00008004

>  <Target> (470)
Bcr-Abl

>  <Form> (470)
Free Base

>  <CAS> (470)
916603-07-1

>  <URL> (470)
https://www.selleckchem.com/products/czc-8004.html

$$$$

csChFnd80/06042111292D

 24 24  0  0  0  0  0  0  0  0999 V2000
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    6.0623    6.3001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    2.1001    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0623    2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  8 17  1  0  0  0  0
  8 20  1  0  0  0  0
  9 18  1  0  0  0  0
  9 21  1  0  0  0  0
 10 13  2  0  0  0  0
 10 14  1  0  0  0  0
 10 16  1  0  0  0  0
 11 13  1  0  0  0  0
 11 15  2  0  0  0  0
 11 17  1  0  0  0  0
 12 14  2  0  0  0  0
 12 15  1  0  0  0  0
 12 18  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
M  END
>  <Mol_ID> (471)
7530

>  <Formula> (471)
C15H21N3O6

>  <MolWeight> (471)
339.34374

>  <Cat> (471)
S0827

>  <Name> (471)
LM22A-4

>  <Synonyms> (471)
LM 22A4

>  <Target> (471)
Trk receptor

>  <Form> (471)
Free Base

>  <CAS> (471)
37988-18-4

>  <URL> (471)
https://www.selleckchem.com/products/lm-22a4.html

$$$$

csChFnd80/06042111292D

 32 36  0  0  0  0  0  0  0  0999 V2000
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   12.2923    5.6084    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.0766    6.0794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5923    4.3960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2229    4.6871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5540    2.9707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3388    1.9844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1 28  1  0  0  0  0
  2  4  1  0  0  0  0
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  3 17  1  0  0  0  0
  3 18  1  0  0  0  0
  3 21  1  0  0  0  0
  4 16  2  0  0  0  0
  5 19  1  0  0  0  0
  5 20  1  0  0  0  0
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  6 16  1  0  0  0  0
  6 22  1  0  0  0  0
  7 21  2  0  0  0  0
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  8 22  1  0  0  0  0
  8 25  2  0  0  0  0
  9 25  1  0  0  0  0
  9 26  1  0  0  0  0
 10 29  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 13  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 21 24  1  0  0  0  0
 22 24  2  0  0  0  0
 26 28  1  0  0  0  0
 27 29  1  0  0  0  0
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 28 30  2  0  0  0  0
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M  END
>  <Mol_ID> (472)
7548

>  <Formula> (472)
C22H31N9O

>  <MolWeight> (472)
437.54124

>  <Cat> (472)
S1272

>  <Name> (472)
XL228

>  <Synonyms> (472)
N/A

>  <Target> (472)
Bcr-Abl. Aurora Kinase. IGF-1R. Src.

>  <Form> (472)
Free Base

>  <CAS> (472)
898280-07-4

>  <URL> (472)
https://www.selleckchem.com/products/xl228.html

$$$$

csChFnd80/06042111292D

 16 17  0  0  0  0  0  0  0  0999 V2000
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  2 15  2  0  0  0  0
  3  8  1  0  0  0  0
  3 10  1  0  0  0  0
  4  9  1  0  0  0  0
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  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 10  2  0  0  0  0
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 15 16  1  0  0  0  0
M  END
>  <Mol_ID> (473)
7562

>  <Formula> (473)
C12H14N2O2

>  <MolWeight> (473)
218.25176

>  <Cat> (473)
S2985

>  <Name> (473)
N-Acetyl-5-hydroxytryptamine

>  <Synonyms> (473)
NAS, N-Acetylserotonin, Normelatonin, O-Demethylmelatonin

>  <Target> (473)
Trk receptor

>  <Form> (473)
Free Base

>  <CAS> (473)
1210-83-9

>  <URL> (473)
https://www.selleckchem.com/products/n-acetyl-5-hydroxytryptamine.html

$$$$

csChFnd80/06042111292D

  1  0  0  0  0  0  0  0  0  0999 V2000
  244.4750 -169.8500    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
A    1
No Structure
M  END
>  <Mol_ID> (474)
7702

>  <Formula> (474)
R

>  <Cat> (474)
S6955

>  <Name> (474)
Insulin (human)

>  <Synonyms> (474)
Insulin regular

>  <Target> (474)
IGF-1R

>  <Form> (474)
Free Base

>  <CAS> (474)
11061-68-0

>  <URL> (474)
https://www.selleckchem.com/products/insulin.html

$$$$

csChFnd80/06042111292D

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 19  7  1  0  0  0  0
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M  END
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7719

>  <Formula> (475)
C32H33ClN8O2

>  <MolWeight> (475)
597.10982

>  <Cat> (475)
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>  <Synonyms> (475)
N/A

>  <Target> (475)
Src

>  <Form> (475)
Free Base

>  <CAS> (475)
unknown

>  <URL> (475)
https://www.selleckchem.com/products/dgy-06-116.html

$$$$

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M  END
>  <Mol_ID> (476)
7757

>  <Formula> (476)
C29H26FN5O3S

>  <MolWeight> (476)
543.6118432

>  <Cat> (476)
S8920

>  <Name> (476)
(Rac)-JBJ-04-125-02

>  <Synonyms> (476)
JBJ-04-125-02 racemate

>  <Target> (476)
EGFR

>  <Form> (476)
Free Base

>  <CAS> (476)
2140807-05-0

>  <URL> (476)
http://www.selleckchem.com/products/jbj-04-125-02.html

$$$$

csChFnd80/06042111292D

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M  END
>  <Mol_ID> (477)
7765

>  <Formula> (477)
C29H29N7O3S

>  <MolWeight> (477)
555.65066

>  <Cat> (477)
S8948

>  <Name> (477)
SRX3207

>  <Synonyms> (477)
N/A

>  <Target> (477)
Syk

>  <Form> (477)
Free Base

>  <CAS> (477)
2254693-15-5

>  <URL> (477)
http://www.selleckchem.com/products/srx3207.html

$$$$

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 38 39  1  0  0  0  0
 39 40  2  0  0  0  0
 40 35  1  0  0  0  0
M  END
>  <Mol_ID> (478)
7774

>  <Formula> (478)
C29H29ClN6O4

>  <MolWeight> (478)
561.03136

>  <Cat> (478)
S9786

>  <Name> (478)
BDTX-189

>  <Synonyms> (478)
N/A

>  <Target> (478)
EGFR

>  <Form> (478)
Free Base

>  <CAS> (478)
2414572-47-5

>  <URL> (478)
http://www.selleckchem.com/products/bdtx-189.html

$$$$

csChFnd80/06042111292D

 36 37  0  0  0  0  0  0  0  0999 V2000
   12.1308    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.8250    9.8784    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    9.8784    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   14.5515    1.3976    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   14.0195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8415    8.4339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6332    7.7315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250   12.6195    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8415    5.6388    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7262    8.4850    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7182    4.1928    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9947    6.3072    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6332   11.9219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250   14.0195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9947    7.7655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9204    3.4987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6332    6.3363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9183    2.0952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1308    4.1953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1308    1.3952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3433    3.4952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    5.6388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3432    2.0952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2167    6.3363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 32  1  0  0  0  0
  4 35  1  0  0  0  0
  5 17  1  0  0  0  0
  5 18  1  0  0  0  0
  6 19  1  0  0  0  0
  6 20  1  0  0  0  0
  7 29  2  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
  9 21  1  0  0  0  0
  9 29  1  0  0  0  0
 10 24  1  0  0  0  0
 10 27  2  0  0  0  0
 11 26  1  0  0  0  0
 11 28  1  0  0  0  0
 12 26  2  0  0  0  0
 12 27  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
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 20 21  2  0  0  0  0
 20 23  1  0  0  0  0
 21 25  1  0  0  0  0
 22 24  1  0  0  0  0
 22 25  2  0  0  0  0
 22 26  1  0  0  0  0
 23 24  2  0  0  0  0
 28 30  2  0  0  0  0
 28 31  1  0  0  0  0
 29 34  1  0  0  0  0
 30 32  1  0  0  0  0
 31 33  2  0  0  0  0
 32 35  2  0  0  0  0
 33 35  1  0  0  0  0
 34 36  2  0  0  0  0
M  END
>  <Mol_ID> (479)
7780

>  <Formula> (479)
C24H27Cl3FN5O3

>  <MolWeight> (479)
558.8602832

>  <Cat> (479)
S0711

>  <Name> (479)
Canertinib dihydrochloride

>  <Synonyms> (479)
CI-1033 dihydrochloride, PD-183805 dihydrochloride

>  <Target> (479)
EGFR

>  <Form> (479)
Dihydrochloride

>  <CAS> (479)
289499-45-2

>  <URL> (479)
http://www.selleckchem.com/products/canertinib-dihydrochloride.html

$$$$

csChFnd80/06042111292D

 41 44  0  0  0  0  0  0  0  0999 V2000
    2.0135    0.0024    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    6.0257    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.8549    0.0023    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.3029    2.8459    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7236    7.0387    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3636    7.0703    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5154   13.3266    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    7.4209    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5154    4.9411    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3029    7.0411    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5718    4.9096    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8469    2.7976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.7236   11.2339    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.7236    4.2435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4236    3.0311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1236    4.2435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3029    4.2411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5154    6.3411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0905    4.9411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0905    6.3411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8469    4.1926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8469    7.0897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3029    8.4363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5718    6.3727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8469    8.4848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5154    9.1363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0905    9.1363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3636    4.2121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5154   10.5363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6447    2.1035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0905   10.5363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4343    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2218    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2217    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7236   12.6291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9318   13.3266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.3281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 37  1  0  0  0  0
  2  8  2  0  0  0  0
  2 40  1  0  0  0  0
  2 41  1  0  0  0  0
  3 33  1  0  0  0  0
  4 17  2  0  0  0  0
  5 18  2  0  0  0  0
  6 24  2  0  0  0  0
  7 38  2  0  0  0  0
  9 14  1  0  0  0  0
  9 17  1  0  0  0  0
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 10 18  1  0  0  0  0
 10 20  1  0  0  0  0
 10 23  1  0  0  0  0
 11 21  1  0  0  0  0
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 11 28  1  0  0  0  0
 12 21  1  0  0  0  0
 12 30  1  0  0  0  0
 13 29  1  0  0  0  0
 13 38  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 16  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 22 24  1  0  0  0  0
 22 25  1  0  0  0  0
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 23 27  2  0  0  0  0
 26 29  2  0  0  0  0
 27 31  1  0  0  0  0
 29 32  1  0  0  0  0
 30 33  2  0  0  0  0
 30 34  1  0  0  0  0
 31 32  2  0  0  0  0
 33 35  1  0  0  0  0
 34 36  2  0  0  0  0
 35 37  2  0  0  0  0
 36 37  1  0  0  0  0
 38 39  1  0  0  0  0
M  END
>  <Mol_ID> (480)
7868

>  <Formula> (480)
C28H29FIN5O5S

>  <MolWeight> (480)
693.5282332

>  <Cat> (480)
S4484

>  <Name> (480)
Trametinib DMSO solvate

>  <Synonyms> (480)
GSK1120212, JTP-74057, Mekinist

>  <Target> (480)
MEK

>  <Form> (480)
Free Base

>  <CAS> (480)
1187431-43-1

>  <URL> (480)
http://www.selleckchem.com/products/trametinib-dmso-solvate.html

$$$$

csChFnd80/06042111292D

 31 35  0  0  0  0  0  0  0  0999 V2000
    5.1544    4.7867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1544    3.3867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3668    2.6867    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5792    3.3867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5792    4.7867    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3668    5.4867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9107    2.9540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7336    4.0867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9107    5.2193    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9419    2.6867    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3433    1.6226    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.7127    1.3315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1454    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6495    2.3719    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.0419    2.2255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6113    3.5045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5709    4.4413    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.3584    3.7413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    4.1213    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.7172    5.8336    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  4  5  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  2  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  5  1  0  0  0  0
  4  3  1  0  0  0  0
  1  2  1  0  0  0  0
  2 10  1  0  0  0  0
  7 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
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 14 15  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 14  1  0  0  0  0
 10 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 10  1  0  0  0  0
 19 23  1  6  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
 25 29  1  0  0  0  0
 28 30  1  0  0  0  0
 17 31  1  1  0  0  0
M  END
>  <Mol_ID> (481)
7877

>  <Formula> (481)
C21H22F2N6O2

>  <MolWeight> (481)
428.4351864

>  <Cat> (481)
S5860

>  <Name> (481)
Larotrectinib

>  <Synonyms> (481)
Vitrakvi, LOXO-101, ARRY-470

>  <Target> (481)
Trk receptor

>  <Form> (481)
Free Base

>  <CAS> (481)
1223403-58-4

>  <URL> (481)
http://www.selleckchem.com/products/larotrectinib.html

$$$$

csChFnd80/06042111292D

 40 41  0  0  0  0  0  0  0  0999 V2000
    9.6995   11.2000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623   10.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 38  1  0  0  0  0
  4  6  2  0  0  0  0
  4  7  2  0  0  0  0
  4 26  1  0  0  0  0
  4 28  1  0  0  0  0
  5 21  1  0  0  0  0
  5 25  1  0  0  0  0
  8 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 23  1  0  0  0  0
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 10 27  1  0  0  0  0
 10 35  2  0  0  0  0
 11 31  1  0  0  0  0
 11 35  1  0  0  0  0
 12 27  2  0  0  0  0
 12 40  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 13 18  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
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 19 24  1  0  0  0  0
 20 21  1  0  0  0  0
 21 23  2  0  0  0  0
 22 23  1  0  0  0  0
 25 29  1  0  0  0  0
 25 30  1  0  0  0  0
 26 32  1  0  0  0  0
 26 33  1  0  0  0  0
 28 31  1  0  0  0  0
 28 34  2  0  0  0  0
 31 36  2  0  0  0  0
 34 37  1  0  0  0  0
 35 38  1  0  0  0  0
 36 39  1  0  0  0  0
 37 39  2  0  0  0  0
 38 40  2  0  0  0  0
M  END
>  <Mol_ID> (482)
7907

>  <Formula> (482)
C28H38Cl3N5O3S

>  <MolWeight> (482)
631.05702

>  <Cat> (482)
S4967

>  <Name> (482)
Ceritinib dihydrochloride

>  <Synonyms> (482)
Zykadia, LDK378 dihydrochloride

>  <Target> (482)
ALK

>  <Form> (482)
Dihydrochloride

>  <CAS> (482)
1380575-43-8

>  <URL> (482)
http://www.selleckchem.com/products/ceritinib-dihydrochloride.html

$$$$

csChFnd80/06042111292D

 31 33  0  0  0  0  0  0  0  0999 V2000
   13.6674    4.6874    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   11.2425    8.8874    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    7.9587    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   16.0922    6.0874    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   11.2425    4.6874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1770    5.1584    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.7194    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8770    6.3708    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8176    1.8874    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.2425    1.8874    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7847    5.0120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2152    3.7331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9618    6.1447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8229    3.5867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5694    5.9983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.3927    4.6874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.6052    3.9874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8176    4.6874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6052    2.5874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0300    3.9874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2425    6.0874    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.0300    2.5874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4549    6.7874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0300    6.7874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6674    6.0874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4549    8.1874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8798    6.7874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6674    8.8874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8798    8.1874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 27  1  0  0  0  0
  2 28  1  0  0  0  0
  4 29  1  0  0  0  0
  5 22  1  0  0  0  0
 23  5  1  6  0  0  0
  6  8  1  0  0  0  0
  6 11  1  0  0  0  0
  6 16  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
  8 18  2  0  0  0  0
  9 21  2  0  0  0  0
  9 24  1  0  0  0  0
 10 24  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 24  2  0  0  0  0
 23 25  1  0  0  0  0
 23 26  1  0  0  0  0
 25 27  1  0  0  0  0
 25 28  2  0  0  0  0
 27 29  2  0  0  0  0
 28 30  1  0  0  0  0
 29 31  1  0  0  0  0
 30 31  2  0  0  0  0
M  END
>  <Mol_ID> (483)
7910

>  <Formula> (483)
C21H23Cl3FN5O

>  <MolWeight> (483)
486.7976232

>  <Cat> (483)
S5190

>  <Name> (483)
Crizotinib hydrochloride

>  <Synonyms> (483)
Xalkori, PF-02341066 hydrochloride

>  <Target> (483)
c-Met

>  <Form> (483)
Hydrochloride

>  <CAS> (483)
1415560-69-8

>  <URL> (483)
http://www.selleckchem.com/products/crizotinib-hydrochloride.html

$$$$

csChFnd80/06042111292D

 33 38  0  0  0  0  0  0  0  0999 V2000
   11.4142    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2017    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4142    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9894    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9894    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2017    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7456    4.6326    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.5685    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7456    2.3673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2017    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9892    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9892    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7767    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5644    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5644    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7767    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3519    9.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3519   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1394   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9271   10.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9271    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1394    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   12.1898    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3623   10.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7146   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3523   12.5521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7769    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7769    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5644    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5644    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3519    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3519    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1396    2.8000    0.0000 N   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
  2  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  3  6  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
  7  1  2  0  0  0  0
  2 10  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 16  1  0  0  0  0
 11 16  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 17 22  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
 23 26  1  0  0  0  0
 20 25  1  0  0  0  0
 14 17  1  0  0  0  0
 10 11  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  2  0  0  0  0
 28 30  2  0  0  0  0
 30 31  1  0  0  0  0
 31 32  2  0  0  0  0
 29 32  1  0  0  0  0
 32 33  1  0  0  0  0
  5 27  1  0  0  0  0
M  END
>  <Mol_ID> (484)
7942

>  <Formula> (484)
C23H25N9O

>  <MolWeight> (484)
443.5043

>  <Cat> (484)
S9715

>  <Name> (484)
Lanraplenib (GS-9876)

>  <Synonyms> (484)
GS-SYK

>  <Target> (484)
Syk

>  <Form> (484)
Free Base

>  <CAS> (484)
1800046-95-0

>  <URL> (484)
http://www.selleckchem.com/products/lanraplenib.html

$$$$

csChFnd80/06042111292D

 34 35  0  0  0  0  0  0  0  0999 V2000
    0.0000    5.4653    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   13.3146    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    9.6994    1.2650    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    8.2653    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.8248    6.8653    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.0248    6.8653    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    5.4650    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   16.9743    6.8645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7615    3.3646    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9120    3.3650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6996    5.4651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.3653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    3.3652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    6.8653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3369    4.7649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5494    5.4647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    4.7646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3367    3.3649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5491    2.6647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742    5.4645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3991    5.4642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 20  1  0  0  0  0
  3 21  1  0  0  0  0
  4 27  1  0  0  0  0
  5 27  1  0  0  0  0
  6 27  1  0  0  0  0
  7 18  1  0  0  0  0
  7 28  1  0  0  0  0
  8 26  2  0  0  0  0
  9 33  2  0  0  0  0
 10 14  1  0  0  0  0
 10 26  1  0  0  0  0
 11 16  1  0  0  0  0
 11 26  1  0  0  0  0
 12 30  2  0  0  0  0
 12 32  1  0  0  0  0
 13 33  1  0  0  0  0
 13 34  1  0  0  0  0
 14 17  2  0  0  0  0
 14 19  1  0  0  0  0
 15 17  1  0  0  0  0
 15 20  2  0  0  0  0
 15 27  1  0  0  0  0
 16 21  2  0  0  0  0
 16 22  1  0  0  0  0
 18 23  2  0  0  0  0
 18 24  1  0  0  0  0
 19 25  2  0  0  0  0
 20 25  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  2  0  0  0  0
 28 29  2  0  0  0  0
 28 31  1  0  0  0  0
 29 30  1  0  0  0  0
 30 33  1  0  0  0  0
 31 32  2  0  0  0  0
M  END
>  <Mol_ID> (485)
7979

>  <Formula> (485)
C21H16Cl2F4N4O3

>  <MolWeight> (485)
519.2763528

>  <Cat> (485)
S4947

>  <Name> (485)
Regorafenib Hydrochloride

>  <Synonyms> (485)
Stivarga, BAY 73-4506 hydrochloride

>  <Target> (485)
VEGFR

>  <Form> (485)
Hydrochloride

>  <CAS> (485)
835621-07-3

>  <URL> (485)
http://www.selleckchem.com/products/regorafenib-hydrochloride.html

$$$$

csChFnd80/06042111292D

 48 43  0  0  0  0  0  0  0  0999 V2000
   17.0439    1.3953    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   18.3579    0.0212    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
   19.7561    1.3650    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
   10.8970    7.6474    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   15.8356    7.6836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2564    4.8858    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0439    2.7905    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0439    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   18.4392    1.3953    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   15.6487    1.3953    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2138    4.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6265    9.0309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2083    7.6286    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5758   11.8143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1758   11.8143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8758   10.4143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4758   10.4143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2758   10.4143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7758   11.8143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8356    4.8834    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3714    4.8348    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.8957    4.8544    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4789    4.8450    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0554    4.8427    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2583    6.9404    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.0481    6.9836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0481    5.5834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4221    6.7413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5253    8.2947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6229    5.5834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6229    6.9836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8356    3.4881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3714    7.7322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1041    5.5520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1027    7.0127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6894    5.5508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6887    6.9498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2638    5.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4681    7.6452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8471    5.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8472    6.9404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.8355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4221    5.5309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6265    7.6357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4167    6.9310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2138    3.4380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4181    9.7286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.9310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  1 10  2  0  0  0  0
  4 37  1  0  0  0  0
  5 26  1  0  0  0  0
  5 31  1  0  0  0  0
  6 27  2  0  0  0  0
  7 32  1  0  0  0  0
 11 43  1  0  0  0  0
 11 46  1  0  0  0  0
 12 44  1  0  0  0  0
 12 47  1  0  0  0  0
 13 45  1  0  0  0  0
 13 48  1  0  0  0  0
 20 27  1  0  0  0  0
 20 30  1  0  0  0  0
 20 32  1  0  0  0  0
 21 30  1  0  0  0  0
 21 34  2  0  0  0  0
 22 34  1  0  0  0  0
 22 36  1  0  0  0  0
 23 36  2  0  0  0  0
 23 38  1  0  0  0  0
 24 38  1  0  0  0  0
 24 40  1  0  0  0  0
 25 38  2  0  0  0  0
 25 39  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
 30 31  2  0  0  0  0
 31 33  1  0  0  0  0
 33 35  2  0  0  0  0
 34 35  1  0  0  0  0
 36 37  1  0  0  0  0
 37 39  2  0  0  0  0
 40 41  2  0  0  0  0
 40 42  1  0  0  0  0
 41 44  1  0  0  0  0
 42 43  2  0  0  0  0
 43 45  1  0  0  0  0
 44 45  2  0  0  0  0
M  END
>  <Mol_ID> (486)
7994

>  <Formula> (486)
C23H36FN6Na2O15P

>  <MolWeight> (486)
732.5148442

>  <Cat> (486)
S4944

>  <Name> (486)
Fostamatinib disodium hexahydrate

>  <Synonyms> (486)
Tavalisse, R788 disodium hexahydrate, Tamatinib Fosdium hexahydrate

>  <Target> (486)
Syk

>  <Form> (486)
Disodium hexahydrate

>  <CAS> (486)
914295-16-2

>  <URL> (486)
http://www.selleckchem.com/products/fostamatinib-disodium-hexahydrate.html

$$$$

csChFnd80/06042111292D

 41 43  0  0  0  0  0  0  0  0999 V2000
   10.9474   11.1516    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.7000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.9124    7.1876    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.5124    9.6124    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9911    8.8183    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374   12.6001    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9374   14.7544    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374   11.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498   10.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248   10.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7700   13.4230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5048   13.4230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3374   14.7544    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
    5.1603   15.8871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    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
    3.6374    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 28  1  0  0  0  0
  3 28  1  0  0  0  0
  4 28  1  0  0  0  0
  5 24  2  0  0  0  0
  7 14  1  0  0  0  0
  7 25  1  0  0  0  0
  7 29  1  0  0  0  0
  8 15  1  0  0  0  0
  8 24  1  0  0  0  0
  9 21  1  0  0  0  0
  9 33  1  0  0  0  0
 10 29  2  0  0  0  0
 10 30  1  0  0  0  0
 11 33  1  0  0  0  0
 11 34  2  0  0  0  0
 12 33  2  0  0  0  0
 12 37  1  0  0  0  0
 13 39  1  0  0  0  0
 13 41  2  0  0  0  0
 14 17  1  0  0  0  0
 14 18  2  0  0  0  0
 15 17  2  0  0  0  0
 15 19  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  2  0  0  0  0
 16 28  1  0  0  0  0
 20 23  2  0  0  0  0
 20 24  1  0  0  0  0
 20 26  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 27  1  0  0  0  0
 22 31  1  0  0  0  0
 25 30  2  0  0  0  0
 26 27  2  0  0  0  0
 30 32  1  0  0  0  0
 34 35  1  0  0  0  0
 34 36  1  0  0  0  0
 35 38  1  0  0  0  0
 35 39  2  0  0  0  0
 36 37  2  0  0  0  0
 38 40  2  0  0  0  0
 40 41  1  0  0  0  0
M  END
>  <Mol_ID> (487)
7995

>  <Formula> (487)
C28H25ClF3N7O2

>  <MolWeight> (487)
583.9920096

>  <Cat> (487)
S4895

>  <Name> (487)
Nilotinib hydrochloride monohydrate

>  <Synonyms> (487)
Tasigna, AMN-107 hydrochloride monohydrate

>  <Target> (487)
Bcr-Abl

>  <Form> (487)
Hydrochloride monohydrate

>  <CAS> (487)
923288-90-8

>  <URL> (487)
http://www.selleckchem.com/products/nilotinib-hydrochloride-monohydrate.html

$$$$
