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azd6244.cdx
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CI1040.cdx
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212631-79-3

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391210-10-9

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$$$$
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M  END
>  <Mol_ID> (5)
32

>  <Formula> (5)
C23H28N8OS

>  <MolWeight> (5)
464.58642

>  <Cat> (5)
S1048

>  <Name> (5)
VX-680 (MK-0457, Tozasertib)

>  <Synonyms> (5)
N/A 

>  <Target> (5)
Aurora Kinase

>  <Form> (5)
Free Base

>  <CAS> (5)
639089-54-6

>  <URL> (5)
http://www.selleckchem.com/products/VX-680(MK-0457).html

$$$$
Y-27632 2HCL.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (6)
33

>  <Formula> (6)
C14H23Cl2N3O

>  <MolWeight> (6)
320.25792

>  <Cat> (6)
S1049

>  <Name> (6)
Y-27632 2HCl

>  <Synonyms> (6)
N/A

>  <Target> (6)
ROCK

>  <Form> (6)
Dihydrochloride

>  <CAS> (6)
129830-38-2

>  <URL> (6)
http://www.selleckchem.com/products/Y-27632.html

$$$$
AZD2281.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (7)
38

>  <Formula> (7)
C24H23FN4O3

>  <MolWeight> (7)
434.4628232

>  <Cat> (7)
S1060

>  <Name> (7)
Olaparib (AZD2281, Ku-0059436)

>  <Synonyms> (7)
KU-0059436 

>  <Target> (7)
PARP 

>  <Form> (7)
Free Base

>  <CAS> (7)
763113-22-0

>  <URL> (7)
http://www.selleckchem.com/products/AZD2281(Olaparib).html

$$$$
untitled.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (8)
42

>  <Formula> (8)
C22H16N4O3

>  <MolWeight> (8)
384.38744

>  <Cat> (8)
S1067

>  <Name> (8)
SB 431542

>  <Synonyms> (8)
N/A

>  <Target> (8)
TGF-beta/Smad

>  <Form> (8)
Free Base

>  <CAS> (8)
301836-41-9

>  <URL> (8)
http://www.selleckchem.com/products/SB-431542.html

$$$$

csChFnd80/05071910222D

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>  <Mol_ID> (9)
48

>  <Formula> (9)
C25H23Cl2N5O

>  <MolWeight> (9)
480.38902

>  <Cat> (9)
S1078

>  <Name> (9)
MK-2206 dihydrochloride

>  <Synonyms> (9)
N/A

>  <Target> (9)
Akt

>  <Form> (9)
Dihydrochloride

>  <CAS> (9)
1032350-13-2

>  <URL> (9)
http://www.selleckchem.com/products/MK-2206.html

$$$$
untitled.cdx
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ATM 

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587871-26-9

>  <URL> (10)
http://www.selleckchem.com/products/KU-55933.html

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>  <Target> (11)
IGF-1R

>  <Form> (11)
Free Base

>  <CAS> (11)
1089283-49-7

>  <URL> (11)
http://www.selleckchem.com/products/GSK1904529A.html

$$$$
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956905-27-4

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

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943540-75-8

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AZD1152 

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Aurora Kinase

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Free Base

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722544-51-6

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

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>  <Mol_ID> (18)
98

>  <Formula> (18)
C27H27N5O3

>  <MolWeight> (18)
469.53498

>  <Cat> (18)
S1167

>  <Name> (18)
CP-724714

>  <Synonyms> (18)
N/A

>  <Target> (18)
EGFR, HER2

>  <Form> (18)
Free Base

>  <CAS> (18)
537705-08-1

>  <URL> (18)
http://www.selleckchem.com/products/CP-724714.html

$$$$
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>  <Mol_ID> (19)
99

>  <Formula> (19)
C21H24N4O2

>  <MolWeight> (19)
364.44086

>  <Cat> (19)
S1169

>  <Name> (19)
TGX-221

>  <Synonyms> (19)
N/A

>  <Target> (19)
PI3K

>  <Form> (19)
Free Base

>  <CAS> (19)
663619-89-4

>  <URL> (19)
http://www.selleckchem.com/products/TGX-221.html

$$$$

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>  <Mol_ID> (20)
103

>  <Formula> (20)
C25H27ClN6O3

>  <MolWeight> (20)
494.97328

>  <Cat> (20)
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>  <Name> (20)
WZ4002

>  <Synonyms> (20)
N/A

>  <Target> (20)
EGFR

>  <Form> (20)
Free Base

>  <CAS> (20)
1213269-23-8

>  <URL> (20)
http://www.selleckchem.com/products/WZ4002.html

$$$$
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csChFnd80/05071910222D

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>  <Mol_ID> (21)
114

>  <Formula> (21)
C21H17NO3

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331.36458

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S1186

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BIBR1532

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N/A

>  <Target> (21)
Telomerase

>  <Form> (21)
Free Base

>  <CAS> (21)
321674-73-1

>  <URL> (21)
http://www.selleckchem.com/products/BIBR1532.html

$$$$
Anastrozole.cdx
csChFnd80/05071910222D

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115

>  <Formula> (22)
C17H19N5

>  <MolWeight> (22)
293.36626

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S1188

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Anastrozole

>  <Synonyms> (22)
Arimidex 

>  <Target> (22)
Aromatase

>  <Form> (22)
Free Base

>  <CAS> (22)
120511-73-1

>  <URL> (22)
http://www.selleckchem.com/products/Anastrozole.html

$$$$
Aprepitant.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (23)
116

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C23H21F7N4O3

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534.4266624

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S1189

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Aprepitant (MK-0869)

>  <Synonyms> (23)
MK-0869, MK-869, L-754030, Emend 

>  <Target> (23)
Substance P

>  <Form> (23)
Free Base

>  <CAS> (23)
170729-80-3

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

$$$$
KU-0063794.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (24)
136

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C25H31N5O4

>  <MolWeight> (24)
465.54474

>  <Cat> (24)
S1226

>  <Name> (24)
Ku-0063794

>  <Synonyms> (24)
N/A

>  <Target> (24)
mTOR 

>  <Form> (24)
Free Base

>  <CAS> (24)
938440-64-3

>  <URL> (24)
http://www.selleckchem.com/products/KU-0063794.html

$$$$
WYE-354.cdx
csChFnd80/05071910222D

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   10.8909   10.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.0229    4.7355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9498    1.0368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0163    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   16.2480    1.7835    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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 23 18  1  0  0  0  0
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 25 26  2  0  0  0  0
 26 15  1  0  0  0  0
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M  END
>  <Mol_ID> (25)
158

>  <Formula> (25)
C24H29N7O5

>  <MolWeight> (25)
495.53096

>  <Cat> (25)
S1266

>  <Name> (25)
WYE-354

>  <Synonyms> (25)
N/A

>  <Target> (25)
mTOR 

>  <Form> (25)
Free Base

>  <CAS> (25)
1062169-56-5

>  <URL> (25)
http://www.selleckchem.com/products/WYE-354.html

$$$$
Azilsartan MedoxoMil.cdx
csChFnd80/05071910222D

 42 47  0  0  0  0  0  0  0  0999 V2000
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   11.4687    2.8045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (26)
200

>  <Formula> (26)
C30H24N4O8

>  <MolWeight> (26)
568.53356

>  <Cat> (26)
S3057

>  <Name> (26)
Azilsartan Medoxomil (TAK-491)

>  <Synonyms> (26)
N/A

>  <Target> (26)
RAAS

>  <Form> (26)
Free Base

>  <CAS> (26)
863031-21-4

>  <URL> (26)
http://www.selleckchem.com/products/azilsartan-medoxomil-tak-491.html

$$$$
TG100-115.cdx
csChFnd80/05071910222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (27)
227

>  <Formula> (27)
C18H14N6O2

>  <MolWeight> (27)
346.34276

>  <Cat> (27)
S1352

>  <Name> (27)
TG100-115

>  <Synonyms> (27)
N/A

>  <Target> (27)
PI3K

>  <Form> (27)
Free Base

>  <CAS> (27)
677297-51-7

>  <URL> (27)
http://www.selleckchem.com/products/TG100-115.html

$$$$
CHIR-99021 (CT99021) hcl.cdx
csChFnd80/05071910222D

 33 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (28)
235

>  <Formula> (28)
C22H19Cl3N8

>  <MolWeight> (28)
501.79886

>  <Cat> (28)
S2924

>  <Name> (28)
CHIR-99021 (CT99021) HCl

>  <Synonyms> (28)
N/A

>  <Target> (28)
PI3K/Akt/mTOR

>  <Form> (28)
Hydrochloride

>  <CAS> (28)
252917-06-9 (free base)

>  <URL> (28)
http://www.selleckchem.com/products/chir-99021-ct99021-hcl.html

$$$$
Aurora A Inhibitor I.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (29)
279

>  <Formula> (29)
C31H31ClFN7O2

>  <MolWeight> (29)
588.0749432

>  <Cat> (29)
S1451

>  <Name> (29)
Aurora A Inhibitor I

>  <Synonyms> (29)
N/A

>  <Target> (29)
Aurora Kinase

>  <Form> (29)
Free Base

>  <CAS> (29)
1158838-45-9

>  <URL> (29)
http://www.selleckchem.com/products/Aurora-A-Inhibitor-I.html

$$$$
Ispinesib, SB-715992.cdx
csChFnd80/05071910222D

 37 40  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (30)
280

>  <Formula> (30)
C30H33ClN4O2

>  <MolWeight> (30)
517.06162

>  <Cat> (30)
S1452

>  <Name> (30)
Ispinesib (SB-715992)

>  <Synonyms> (30)
N/A 

>  <Target> (30)
Kinesin

>  <Form> (30)
Free Base

>  <CAS> (30)
336113-53-2

>  <URL> (30)
http://www.selleckchem.com/products/Ispinesib-mesilate(SB-715992).html

$$$$
untitled.cdx
csChFnd80/05071910222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (31)
284

>  <Formula> (31)
C19H16N6O4S

>  <MolWeight> (31)
424.43314

>  <Cat> (31)
S1456

>  <Name> (31)
Zibotentan (ZD4054)

>  <Synonyms> (31)
N/A

>  <Target> (31)
ETA Receptor

>  <Form> (31)
Free Base

>  <CAS> (31)
186497-07-4

>  <URL> (31)
http://www.selleckchem.com/products/Zibotentan(ZD4054).html

$$$$
FCE28073.cdx
csChFnd80/05071910222D

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MAO

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202825-46-5

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ROCK 

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Free Base

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864082-47-3

>  <URL> (33)
http://www.selleckchem.com/products/GSK429286A.html

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296

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MEK 

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1236699-92-5

>  <URL> (34)
http://www.selleckchem.com/products/AS703026.html

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314

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Tadalafil (Cialis)

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PDE

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Free Base

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171596-29-5

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

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320

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Wee1

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Free Base

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955365-80-7

>  <URL> (36)
http://www.selleckchem.com/products/MK-1775.html

$$$$
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csChFnd80/05071910222D

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334

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C21H25ClO6

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408.8726

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Dapagliflozin

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BMS-512148

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SGLT 

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Free Base

>  <CAS> (37)
461432-26-8

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

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Pimobendan.cdx
csChFnd80/05071910222D

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335

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S1550

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Pimobendan (Vetmedin)

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Acardi, pimobendane

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PDE

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Free Base

>  <CAS> (38)
74150-27-9

>  <URL> (38)
http://www.selleckchem.com/products/Pimobendan(Vetmedin).html

$$$$
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csChFnd80/05071910222D

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mTOR

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1009298-09-2

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49843-98-3

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>  <Mol_ID> (41)
350

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>  <Synonyms> (41)
N/A

>  <Target> (41)
ATM 

>  <Form> (41)
Free Base

>  <CAS> (41)
925701-49-1

>  <URL> (41)
http://www.selleckchem.com/products/KU-60019.html

$$$$
Tie 2k inase inhibitor.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (42)
354

>  <Formula> (42)
C26H21N3O2S

>  <MolWeight> (42)
439.52884

>  <Cat> (42)
S1577

>  <Name> (42)
Tie2 kinase inhibitor

>  <Synonyms> (42)
N/A

>  <Target> (42)
Tie-2

>  <Form> (42)
Free Base

>  <CAS> (42)
948557-43-5

>  <URL> (42)
http://www.selleckchem.com/products/Tie2-kinase-inhibitor.html

$$$$
Apixaban.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (43)
357

>  <Formula> (43)
C25H25N5O4

>  <MolWeight> (43)
459.4971

>  <Cat> (43)
S1593

>  <Name> (43)
Apixaban

>  <Synonyms> (43)
N/A

>  <Target> (43)
Factor Xa 

>  <Form> (43)
Free Base

>  <CAS> (43)
503612-47-3

>  <URL> (43)
http://www.selleckchem.com/products/Apixaban(BMS-562247-01).html

$$$$
CTEP.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (44)
473

>  <Formula> (44)
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>  <Cat> (44)
S2861

>  <Name> (44)
CTEP (RO4956371)

>  <Synonyms> (44)
N/A

>  <Target> (44)
GluR

>  <Form> (44)
Free Base

>  <CAS> (44)
871362-31-1

>  <URL> (44)
http://www.selleckchem.com/products/ctep.html

$$$$
Raltegravir.cdx
csChFnd80/05071910222D

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498

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C20H21FN6O5

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Raltegravir (MK-0518)

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Isentress 

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Integrase

>  <Form> (45)
Free Base

>  <CAS> (45)
518048-05-0

>  <URL> (45)
http://www.selleckchem.com/products/Raltegravir-(MK-0518).html

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575

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C31H34Cl2N2O3

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S2182 

>  <Name> (46)
SB743921 HCl

>  <Synonyms> (46)
N/A

>  <Target> (46)
Kinesin

>  <Form> (46)
Hydrochloride

>  <CAS> (46)
940929-33-9

>  <URL> (46)
http://www.selleckchem.com/products/SB-743921.html

$$$$
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>  <Mol_ID> (47)
579

>  <Formula> (47)
C23H25ClFN5O3

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S2192

>  <Name> (47)
AZD8931

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N/A

>  <Target> (47)
EGFR, HER2

>  <Form> (47)
Free Base

>  <CAS> (47)
848942-61-0

>  <URL> (47)
http://www.selleckchem.com/products/AZD8931.html

$$$$
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PLK

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929095-18-1

>  <URL> (48)
http://www.selleckchem.com/products/GSK461364.html

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Mubritinib.cdx
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>  <Target> (49)
HER2

>  <Form> (49)
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>  <CAS> (49)
366017-09-6

>  <URL> (49)
http://www.selleckchem.com/products/Mubritinib-TAK-165.html

$$$$
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Cryptotanshinone

>  <Synonyms> (50)
N/A

>  <Target> (50)
STAT

>  <Form> (50)
Free Base

>  <CAS> (50)
35825-57-1

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

$$$$
Icariin.cdx
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>  <Cat> (51)
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Icariin

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N/A

>  <Target> (51)
PDE

>  <Form> (51)
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>  <CAS> (51)
489-32-7

>  <URL> (51)
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702

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C25H24N6O2

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PCI-32765 (Ibrutinib)

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N/A

>  <Target> (52)
Src

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Free Base

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936563-96-1

>  <URL> (52)
http://www.selleckchem.com/products/pci-32765.html

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untitled.cdx
csChFnd80/05071910222D

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745

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C19H18ClN3O5S

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N/A 

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Factor Xa

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Free Base

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366789-02-8

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

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764

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C21H22N6O3

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406.43778

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S2624

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OSI-027

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N/A 

>  <Target> (54)
mTOR

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Free Base

>  <CAS> (54)
936890-98-1

>  <URL> (54)
http://www.selleckchem.com/products/OSI027.html

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URB597.cdx
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FAAH

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Free Base

>  <CAS> (55)
546141-08-6 

>  <URL> (55)
http://www.selleckchem.com/products/urb597.html

$$$$
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1292799-56-4 

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603139-19-1

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C14H16ClF2N3S

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Nepicastat hydrochloride

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Hydrochloride

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170151-24-3

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

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Free Base

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264218-23-7

>  <URL> (69)
http://www.selleckchem.com/products/sb-415286.html

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mTOR 

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Free Base

>  <CAS> (70)
1224844-38-5

>  <URL> (70)
http://www.selleckchem.com/products/ink128.html

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DPP-4

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668270-12-0

>  <URL> (71)
http://www.selleckchem.com/products/linagliptin-bi-1356.html

$$$$
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Aurora Kinase

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1010085-13-8

>  <URL> (72)
http://www.selleckchem.com/products/mk-5108-vx-689.html

$$$$
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944261-79-4

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http://www.selleckchem.com/products/a-803467.html

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504433-23-2

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http://www.selleckchem.com/products/gw-441756.html

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>  <Target> (91)
5-HT Receptor

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Free Base

>  <CAS> (91)
607742-69-8

>  <URL> (91)
http://www.selleckchem.com/products/sb-742457.html

$$$$
ZM323881 HCl.cdx
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>  <Mol_ID> (92)
1135

>  <Formula> (92)
C22H19ClFN3O2

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S2896

>  <Name> (92)
ZM 323881 HCl

>  <Synonyms> (92)
N/A

>  <Target> (92)
VEGFR

>  <Form> (92)
Hydrochloride

>  <CAS> (92)
193000-39-4

>  <URL> (92)
http://www.selleckchem.com/products/zm-323881-hcl.html

$$$$
Lumiracoxib.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (93)
1139

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C15H13ClFNO2

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Lumiracoxib (COX-189)

>  <Synonyms> (93)
N/A

>  <Target> (93)
COX

>  <Form> (93)
Free Base

>  <CAS> (93)
220991-20-8

>  <URL> (93)
http://www.selleckchem.com/products/lumiracoxib-cox-189.html

$$$$
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>  <Mol_ID> (94)
1140

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C14H16ClN3O

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>  <Target> (94)
Histamine Receptor

>  <Form> (94)
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>  <CAS> (94)
459168-41-3

>  <URL> (94)
http://www.selleckchem.com/products/jnj-7777120.html

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IOX2.cdx
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M  END
>  <Mol_ID> (104)
1285

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C27H24N2O9

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JZL184

>  <Synonyms> (104)
N/A

>  <Target> (104)
Lipase

>  <Form> (104)
Free Base

>  <CAS> (104)
1101854-58-3

>  <URL> (104)
http://www.selleckchem.com/products/jzl184.html

$$$$
RIMADYL (carprofen).cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (105)
1348

>  <Formula> (105)
C15H12ClNO2

>  <MolWeight> (105)
273.71428

>  <Cat> (105)
S4136

>  <Name> (105)
Carprofen

>  <Synonyms> (105)
N/A

>  <Target> (105)
COX

>  <Form> (105)
Free Base

>  <CAS> (105)
53716-49-7

>  <URL> (105)
http://www.selleckchem.com/products/carprofen.html

$$$$
Eprosartan mesylate.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (106)
1405

>  <Formula> (106)
C24H28N2O7S2

>  <MolWeight> (106)
520.61832

>  <Cat> (106)
S4102

>  <Name> (106)
Eprosartan Mesylate

>  <Synonyms> (106)
N/A

>  <Target> (106)
RAAS

>  <Form> (106)
Mesylate

>  <CAS> (106)
144143-96-4 

>  <URL> (106)
http://www.selleckchem.com/products/eprosartan-mesylate.html

$$$$
Refametinib (RDEA119, Bay 86-9766) .cdx
csChFnd80/05071910222D

 31 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (107)
1505

>  <Formula> (107)
C19H20F3IN2O5S

>  <MolWeight> (107)
572.3371796

>  <Cat> (107)
S1089

>  <Name> (107)
Refametinib (RDEA119, Bay 86-9766)

>  <Synonyms> (107)
BAY 869766

>  <Target> (107)
MEK

>  <Form> (107)
Free Base

>  <CAS> (107)
923032-37-5

>  <URL> (107)
http://www.selleckchem.com/products/refametinib-rdea119-bay86-9766.html

$$$$
Nebivolol HCl (R-067555).cdx
csChFnd80/05071910222D

 32 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (108)
1533

>  <Formula> (108)
C22H26ClF2NO4

>  <MolWeight> (108)
441.8959464

>  <Cat> (108)
S1549

>  <Name> (108)
Nebivolol HCl

>  <Synonyms> (108)
N/A

>  <Target> (108)
Adrenergic Receptor

>  <Form> (108)
Hydrochloride

>  <CAS> (108)
152520-56-4

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

$$$$
(R)-Nepicastat HCL(RS-25560-198).cdx
csChFnd80/05071910222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (109)
1544

>  <Formula> (109)
C14H16ClF2N3S

>  <MolWeight> (109)
331.8117464

>  <Cat> (109)
S4926

>  <Name> (109)
(R)-Nepicastat HCl

>  <Synonyms> (109)
RS-25560-198 HCl

>  <Target> (109)
Hydroxylase

>  <Form> (109)
Hydrochloride

>  <CAS> (109)
195881-94-8

>  <URL> (109)
http://www.selleckchem.com/products/r-nepicastat-hcl.html

$$$$
S4002.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (110)
1553

>  <Formula> (110)
C16H20F6N5O6P

>  <MolWeight> (110)
523.3240802

>  <Cat> (110)
S4002

>  <Name> (110)
Sitagliptin phosphate monohydrate

>  <Synonyms> (110)
MK-0431

>  <Target> (110)
DPP-4

>  <Form> (110)
phosphate &monohydrate

>  <CAS> (110)
654671-77-9

>  <URL> (110)
http://www.selleckchem.com/products/Sitagliptin.html

$$$$
S1263.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (111)
1562

>  <Formula> (111)
C22H18Cl2N8

>  <MolWeight> (111)
465.33792

>  <Cat> (111)
S1263

>  <Name> (111)
CHIR-99021 (CT99021)

>  <Synonyms> (111)
N/A

>  <Target> (111)
GSK-3

>  <Form> (111)
Free Base

>  <CAS> (111)
252917-06-9

>  <URL> (111)
http://www.selleckchem.com/products/CHIR-99021.html

$$$$
S4697 Saxagliptin hydrate.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (112)
1693

>  <Formula> (112)
C18H27N3O3

>  <MolWeight> (112)
333.42528

>  <Cat> (112)
S4697

>  <Name> (112)
Saxagliptin hydrate 

>  <Synonyms> (112)
BMS-477118 hydrate, Onglyza hydrate, BMS 477118 hydrate, BMS477118 hydrate

>  <Target> (112)
DPP-4

>  <Form> (112)
hydrate

>  <CAS> (112)
945667-22-1

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

$$$$
MK4827.cdx
csChFnd80/05071910222D

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   12.2695    0.1876    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.9695    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2695    2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8695    2.6124    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  1  0  0  0  0
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  6 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
  8 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
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 18 13  1  0  0  0  0
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M  END
>  <Mol_ID> (113)
1721

>  <Formula> (113)
C19H20N4O

>  <MolWeight> (113)
320.3883

>  <Cat> (113)
S2741

>  <Name> (113)
MK-4827(Niraparib)

>  <Synonyms> (113)
N/A

>  <Target> (113)
PARP

>  <Form> (113)
Free Base

>  <CAS> (113)
1038915-60-4

>  <URL> (113)
http://www.selleckchem.com/products/mk-4827.html

$$$$
S3673 Sulfaphenazole.cdx
csChFnd80/05071910222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    7.4337    4.1941    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2995    5.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4337    2.7980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.9678    4.5471    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7173    6.3487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6579    2.1065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2346    2.0952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1227    6.3562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9806    5.5344    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    8.6660    0.7010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2323    0.6922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9933    6.5217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3055    7.8501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6401    6.1148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3029    8.8184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6379    7.0827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9872    8.4533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    9.4406    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
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
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  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6  9  1  0  0  0  0
  7 11  2  0  0  0  0
  8 12  1  0  0  0  0
 10 13  1  0  0  0  0
 10 14  2  0  0  0  0
 10 15  2  0  0  0  0
 11 16  1  0  0  0  0
 12 16  2  0  0  0  0
 13 17  2  0  0  0  0
 13 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (114)
1825

>  <Formula> (114)
C15H14N4O2S

>  <MolWeight> (114)
314.36226

>  <Cat> (114)
S3673

>  <Name> (114)
Sulfaphenazole

>  <Synonyms> (114)
Depocid, Depotsulfonamide, Plisulfan, Raziosulfa

>  <Target> (114)
CYP2C9

>  <Form> (114)
free base

>  <CAS> (114)
526-08-9

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

$$$$
S4800 Daminozide.cdx
csChFnd80/05071910222D

 11 10  0  0  0  0  0  0  0  0999 V2000
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 N   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
    8.4870    1.4000    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
    0.0000    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
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  7 10  1  0  0  0  0
  7 11  2  0  0  0  0
M  END
>  <Mol_ID> (115)
2052

>  <Formula> (115)
C6H12N2O3

>  <MolWeight> (115)
160.17108

>  <Cat> (115)
S4800

>  <Name> (115)
Daminozide

>  <Synonyms> (115)
Aminozide, Succinic Acid

>  <Target> (115)
PHF8,KDM2A 

>  <Form> (115)
free base

>  <CAS> (115)
1596-84-5

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

$$$$
S4854 Bedaquiline fumarate.cdx
csChFnd80/05071910222D

 45 48  0  0  0  0  0  0  0  0999 V2000
    7.6344    8.5760    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    9.0327   10.3937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.8453    7.8768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0697    8.5837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2815    7.8841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2815    6.4815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0620    5.7774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8451    6.4800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2362   10.3937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5434    9.1938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1294    9.1938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.1300   11.6046    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8292   10.3937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8559    5.5666    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0602    6.2619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  4  1  0  0  0  0
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M  END
>  <Mol_ID> (116)
2118

>  <Formula> (116)
C36H35BrN2O6

>  <MolWeight> (116)
671.5769

>  <Cat> (116)
S4854

>  <Name> (116)
Bedaquiline fumarate

>  <Synonyms> (116)
TMC-207

>  <Target> (116)
Antifection

>  <Form> (116)
fumarate

>  <CAS> (116)
845533-86-0

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

$$$$
S4935 Asunaprevir.cdx
csChFnd80/05071910222D

 51 55  0  0  0  0  0  0  0  0999 V2000
   11.6416    9.7408    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.2495    9.5925    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (117)
2121

>  <Formula> (117)
C35H46ClN5O9S

>  <MolWeight> (117)
748.28584

>  <Cat> (117)
S4935

>  <Name> (117)
Asunaprevir

>  <Synonyms> (117)
BMS-650032

>  <Target> (117)
hepatitis C virus enzyme serine protease NS

>  <Form> (117)
free base

>  <CAS> (117)
630420-16-5

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

$$$$
Alogliptin(SYR-322).cdx
csChFnd80/05071910222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (118)
2240

>  <Formula> (118)
C18H21N5O2

>  <MolWeight> (118)
339.39164

>  <Cat> (118)
S2868

>  <Name> (118)
Alogliptin£¨SYR-322£©

>  <Synonyms> (118)
N/A

>  <Target> (118)
DPP-4

>  <Form> (118)
Free Base

>  <CAS> (118)
850649-61-5

>  <URL> (118)
http://www.selleckchem.com/products/alogliptin-syr-322.html

$$$$
Alogliptin(SYR-322).cdx
csChFnd80/05071910222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    7.2746    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (119)
2254

>  <Formula> (119)
C18H21N5O2

>  <MolWeight> (119)
339.39164

>  <Cat> (119)
S5365

>  <Name> (119)
Alogliptin

>  <CAS> (119)
850649-61-5

$$$$
pim inhibitor I(SMI-4a).cdx
csChFnd80/05071910222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (120)
2271

>  <Formula> (120)
C11H6F3NO2S

>  <MolWeight> (120)
273.2310496

>  <Cat> (120)
S8005

>  <Name> (120)
SMI-4a

>  <Synonyms> (120)
N/A

>  <Target> (120)
Pim

>  <Form> (120)
Free Base

>  <CAS> (120)
438190-29-5

>  <URL> (120)
http://www.selleckchem.com/products/smi-4a.html

$$$$
CP 945598 hydrochloride.cdx
csChFnd80/05071910222D

 36 39  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (121)
2281

>  <Formula> (121)
C25H26Cl3N7O

>  <MolWeight> (121)
546.87924

>  <Cat> (121)
S8012

>  <Name> (121)
CP-945598 HCl

>  <Synonyms> (121)
N/A

>  <Target> (121)
Cannabinoid Receptor

>  <Form> (121)
Hydrochloride

>  <CAS> (121)
686347-12-6

>  <URL> (121)
http://www.selleckchem.com/products/cp-945598-hcl.html

$$$$
flt-3 inhibitor I(TCS 359).cdx
csChFnd80/05071910222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (130)
2329

>  <Formula> (130)
C18H13N7S

>  <MolWeight> (130)
359.40772

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S1112

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SGX-523

>  <Synonyms> (130)
N/A

>  <Target> (130)
c-Met 

>  <Form> (130)
Free Base

>  <CAS> (130)
1022150-57-7

>  <URL> (130)
http://www.selleckchem.com/products/SGX-523.html

$$$$
s1023.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (131)
2331

>  <Formula> (131)
C22H24ClN3O4

>  <MolWeight> (131)
429.89666

>  <Cat> (131)
S1023

>  <Name> (131)
Erlotinib(OSI-744)

>  <Synonyms> (131)
(CP358774, NSC 718781) HCl

>  <Target> (131)
EGFR

>  <Form> (131)
Hydrochloride

>  <CAS> (131)
183319-69-9

>  <URL> (131)
http://www.selleckchem.com/products/Erlotinib-Hydrochloride.

$$$$
(-)-Huperzine A.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (132)
2389

>  <Formula> (132)
C15H18N2O

>  <MolWeight> (132)
242.31622

>  <Cat> (132)
S2251

>  <Name> (132)
(-)-Huperzine A (HupA)

>  <Synonyms> (132)
N/A

>  <Target> (132)
AChR & GluR

>  <Form> (132)
Free Base

>  <CAS> (132)
102518-79-6

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

$$$$
GSK256066.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (133)
2405

>  <Formula> (133)
C27H26N4O5S

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518.58414

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>  <Name> (133)
GSK256066

>  <Synonyms> (133)
GSK-256066

>  <Target> (133)
PDE

>  <Form> (133)
Free Base

>  <CAS> (133)
801312-28-7

>  <URL> (133)
http://www.selleckchem.com/products/gsk256066.html

$$$$
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csChFnd80/05071910222D

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M  END
>  <Mol_ID> (134)
2428

>  <Formula> (134)
C26H31BrN8O

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551.48134

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CCT137690

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N/A

>  <Target> (134)
Aurora Kinase

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Free Base

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1095382-05-0

>  <URL> (134)
http://www.selleckchem.com/products/cct137690.html

$$$$
INCB28060.cdx
csChFnd80/05071910222D

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2430

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C23H17FN6O

>  <MolWeight> (135)
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>  <Cat> (135)
S2788

>  <Name> (135)
Capmatinib (INCB28060)

>  <Synonyms> (135)
N/A

>  <Target> (135)
c-Met 

>  <Form> (135)
Free Base

>  <CAS> (135)
1029712-80-8

>  <URL> (135)
http://www.selleckchem.com/products/incb28060.html

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IPA-3.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (136)
2444

>  <Formula> (136)
C20H14O2S2

>  <MolWeight> (136)
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>  <Cat> (136)
S7093

>  <Name> (136)
IPA-3

>  <Synonyms> (136)
N/A

>  <Target> (136)
PAK

>  <Form> (136)
Free Base

>  <CAS> (136)
42521-82-4

>  <URL> (136)
https://www.selleckchem.com/products/ipa-3.html

$$$$
TCID.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (137)
2462

>  <Formula> (137)
C9H2Cl4O2

>  <MolWeight> (137)
283.92298

>  <Cat> (137)
S7140

>  <Name> (137)
TCID

>  <Synonyms> (137)
UCH-L3 Inhibitor

>  <Target> (137)
DUB

>  <Form> (137)
Free Base

>  <CAS> (137)
30675-13-9

>  <URL> (137)
http://www.selleckchem.com/products/tcid.html

$$$$
CNX-2006.cdx
csChFnd80/05071910222D

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EGFR

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1375465-09-0

>  <URL> (138)
http://www.selleckchem.com/products/cnx-2006.html

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418805-02-4

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http://www.selleckchem.com/products/pyr-41.html

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EPZ005687

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N/A

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Histone Methyltransferase

>  <Form> (140)
Free Base

>  <CAS> (140)
1396772-26-1

>  <URL> (140)
http://www.selleckchem.com/products/epz005687.html

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S1P Receptor

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312636-16-1

>  <URL> (141)
http://www.selleckchem.com/products/ski-ii.html

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>  <CAS> (142)
1227911-45-6

>  <URL> (142)
http://www.selleckchem.com/products/gsk2334470.html

$$$$
Thiamet G.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (143)
2523

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C9H16N2O4S

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248.29934

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S7213

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Thiamet G 

>  <Synonyms> (143)
N/A

>  <Target> (143)
Others

>  <Form> (143)
Free Base

>  <CAS> (143)
1009816-48-1

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

$$$$
RGFP966.cdx
csChFnd80/05071910222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (144)
2526

>  <Formula> (144)
C21H19FN4O

>  <MolWeight> (144)
362.4001632

>  <Cat> (144)
S7229

>  <Name> (144)
RGFP966

>  <Synonyms> (144)
N/A

>  <Target> (144)
HDAC

>  <Form> (144)
Free Base

>  <CAS> (144)
1396841-57-8

>  <URL> (144)
http://www.selleckchem.com/products/rgfp966.html

$$$$
dynasore .cdx
csChFnd80/05071910222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (145)
2531

>  <Formula> (145)
C18H14N2O4

>  <MolWeight> (145)
322.31476

>  <Cat> (145)
S8047

>  <Name> (145)
Dynasore

>  <Synonyms> (145)
N/A

>  <Target> (145)
Dynamin

>  <Form> (145)
Free Base

>  <CAS> (145)
304448-55-3

>  <URL> (145)
http://www.selleckchem.com/products/dynasore.html

$$$$
SGC 0946.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (146)
2533

>  <Formula> (146)
C28H40BrN7O4

>  <MolWeight> (146)
618.5657

>  <Cat> (146)
S7079

>  <Name> (146)
SGC 0946

>  <Synonyms> (146)
N/A

>  <Target> (146)
Histone Methyltransferase

>  <Form> (146)
Free Base

>  <URL> (146)
http://www.selleckchem.com/products/sgc-0946.html

$$$$
AZD1981.cdx
csChFnd80/05071910222D

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Histone Methyltransferase

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1403254-99-8

>  <URL> (151)
http://www.selleckchem.com/products/epz-6438.html

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SSR

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FGFR

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Free Base

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848318-25-2

>  <URL> (152)
http://www.selleckchem.com/products/ssr128129e.html

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UNC1999

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N/A

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Histone Methyltransferase

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Free Base

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1431612-23-5

>  <URL> (153)
http://www.selleckchem.com/products/unc1999.html

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1337531-36-8

>  <URL> (154)
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885325-71-3

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1469924-27-3

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

$$$$
LM-3230 NH125.cdx
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iodide

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278603-08-0

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$$$$
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C25H23ClN6

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LDN193189 HCl

>  <Synonyms> (164)
N/A

>  <Target> (164)
TGF-beta/Smad

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Hydrochloride

>  <CAS> (164)
1062368-62-0

>  <URL> (164)
http://www.selleckchem.com/products/ldn-193189-HCl.html

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GSK-3

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Free Base

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676596-65-9

>  <URL> (165)
http://www.selleckchem.com/products/1-azakenpaullone.html

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PERK

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Free Base

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Nexturastat A

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Free Base

>  <CAS> (167)
1403783-31-2

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

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1432660-47-3

>  <URL> (168)
http://www.selleckchem.com/products/agi-6780.html

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N/A

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Serine Protease

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Free Base

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848141-11-7

>  <URL> (174)
http://www.selleckchem.com/products/avelestat-azd9668.html

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PF-543

>  <Synonyms> (175)
N/A

>  <Target> (175)
S1P Receptor

>  <Form> (175)
Free Base

>  <CAS> (175)
1415562-82-1

>  <URL> (175)
http://www.selleckchem.com/products/pf-543.html

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EMD 1214063.cdx
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c-Met

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1100598-32-0

>  <URL> (176)
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LDC000067.cdx
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292605-14-2

>  <URL> (182)
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1477949-42-0

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1034616-18-6

>  <URL> (184)
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C23H25F4N3O3S

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S7294

>  <Name> (186)
PFI-2 HCl

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N/A

>  <Target> (186)
Histone Methyltransferase

>  <Form> (186)
Hydrochloride

>  <CAS> (186)
1627676-59-8

>  <URL> (186)
http://www.selleckchem.com/products/pfi-2.html

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2819

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C25H24N4O2

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Bisindolylmaleimide I (GF109203X)

>  <Synonyms> (187)
GO 6850

>  <Target> (187)
PKC

>  <Form> (187)
Free Base

>  <CAS> (187)
133052-90-1

>  <URL> (187)
http://www.selleckchem.com/products/gf109203x.html

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2820

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C27H35F2N7O3

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Ro3280

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Ro5203280

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PLK

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Free Base

>  <CAS> (188)
1062243-51-9

>  <URL> (188)
http://www.selleckchem.com/products/ro3280.html

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>  <Name> (189)
JNK inhibitor IX

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TCS JNK 5a

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JNK

>  <Form> (189)
Free Base

>  <CAS> (189)
312917-14-9

>  <URL> (189)
http://www.selleckchem.com/products/jnk-inhibitor-ix.html

$$$$
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Others

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521937-07-5

>  <URL> (190)
http://www.selleckchem.com/products/cid755673.html

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M  END
>  <Mol_ID> (195)
2851

>  <Formula> (195)
C22H30N4O6

>  <MolWeight> (195)
446.4968

>  <Cat> (195)
S7596

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CAY10603

>  <Synonyms> (195)
N/A

>  <Target> (195)
HDAC

>  <Form> (195)
Free Base

>  <CAS> (195)
1045792-66-2

>  <URL> (195)
http://www.selleckchem.com/products/cay10603.html

$$$$
TH588.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (196)
2868

>  <Formula> (196)
C13H12Cl2N4

>  <MolWeight> (196)
295.16718

>  <Cat> (196)
S7632

>  <Name> (196)
TH588

>  <Synonyms> (196)
N/A

>  <Target> (196)
MTH1

>  <Form> (196)
Free Base

>  <CAS> (196)
1609960-31-7

>  <URL> (196)
http://www.selleckchem.com/products/th588.html

$$$$
FTI 277 HCl.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (197)
2874

>  <Formula> (197)
C22H30ClN3O3S2

>  <MolWeight> (197)
484.0749

>  <Cat> (197)
S7465

>  <Name> (197)
FTI 277 HCl

>  <Synonyms> (197)
N/A

>  <Target> (197)
Transferase

>  <Form> (197)
hydrochloride salt

>  <CAS> (197)
180977-34-8

>  <URL> (197)
http://www.selleckchem.com/products/fti-277-hcl.html

$$$$
SBE 13 hydrochloride.cdx
csChFnd80/05071910222D

 32 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (198)
2876

>  <Formula> (198)
C24H28Cl2N2O4

>  <MolWeight> (198)
479.39612

>  <Cat> (198)
S7720

>  <Name> (198)
SBE 13 HCl

>  <Synonyms> (198)
N/A

>  <Target> (198)
PLK

>  <Form> (198)
Hydrochloride

>  <CAS> (198)
1052532-15-6

>  <URL> (198)
http://www.selleckchem.com/products/sbe-13-hcl.html

$$$$
SD208.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (199)
2879

>  <Formula> (199)
C17H10ClFN6

>  <MolWeight> (199)
352.7529032

>  <Cat> (199)
S7624

>  <Name> (199)
SD-208

>  <Synonyms> (199)
N/A

>  <Target> (199)
TGF-beta/Smad

>  <Form> (199)
Free Base

>  <CAS> (199)
627536-09-8

>  <URL> (199)
http://www.selleckchem.com/products/sd-208.html

$$$$
LFM-A13.cdx
csChFnd80/05071910222D

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A   27
(S)-2-(3-(pyridin-2-ylmethoxy)pyrrolidin-1-yl)-5-(trifluoromethyl)benzoic acid
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1515856-92-4

>  <URL> (201)
http://www.selleckchem.com/products/xen445.html

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953769-46-5

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603288-22-8

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2895

>  <Formula> (204)
C14H22Cl2N2

>  <MolWeight> (204)
289.24388

>  <Cat> (204)
S7574

>  <Name> (204)
GSK-LSD1 2HCl

>  <Synonyms> (204)
N/A

>  <Target> (204)
Histone Demethylase

>  <Form> (204)
Dihydrochloride

>  <CAS> (204)
1431368-48-7

>  <URL> (204)
http://www.selleckchem.com/products/gsk-lsd1-2hcl.html

$$$$
GSK126.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (205)
2898

>  <Formula> (205)
C31H38N6O2

>  <MolWeight> (205)
526.67242

>  <Cat> (205)
S7061

>  <Name> (205)
GSK126

>  <Synonyms> (205)
N/A

>  <Target> (205)
Histone Methyltransferase

>  <Form> (205)
Free Base

>  <CAS> (205)
1346574-57-9

>  <URL> (205)
http://www.selleckchem.com/products/gsk126.html

$$$$
EPZ015666.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (206)
2902

>  <Formula> (206)
C20H25N5O3

>  <MolWeight> (206)
383.4442

>  <Cat> (206)
S7748

>  <Name> (206)
EPZ015666

>  <Synonyms> (206)
N/A

>  <Target> (206)
Histone Methyltransferase

>  <Form> (206)
Free Base

>  <CAS> (206)
1616391-65-1

>  <URL> (206)
http://www.selleckchem.com/products/epz015666.html

$$$$
Erlotinib free Base.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (207)
2907

>  <Formula> (207)
C22H23N3O4

>  <MolWeight> (207)
393.43572

>  <Cat> (207)
S7786

>  <Name> (207)
Erlotinib

>  <Synonyms> (207)
CP358774, NSC 718781

>  <Target> (207)
EGFR

>  <Form> (207)
Free Base

>  <CAS> (207)
183321-74-6

>  <URL> (207)
http://www.selleckchem.com/products/erlotinib.html

$$$$
PD-0332991 hydrochloride.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (208)
2910

>  <Formula> (208)
C24H30ClN7O2

>  <MolWeight> (208)
483.9937

>  <Cat> (208)
S1116

>  <Name> (208)
PD 0332991 (Palbociclib) HCl

>  <Synonyms> (208)
N/A

>  <Target> (208)
CDK

>  <Form> (208)
Hydrochloride

>  <CAS> (208)
827022-32-2, 571190-30-2 (free base)

>  <URL> (208)
http://www.selleckchem.com/products/PD-0332991.html

$$$$
PF-00080665.cdx
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M  END
>  <Mol_ID> (209)
2911

>  <Formula> (209)
C26H35N7O6S

>  <MolWeight> (209)
573.6644

>  <Cat> (209)
S1579

>  <Name> (209)
PD 0332991 (Palbociclib) Isethionate

>  <Synonyms> (209)
N/A

>  <Target> (209)
CDK

>  <Form> (209)
Isethionate

>  <CAS> (209)
827022-33-3, 571190-30-2(free base)

>  <URL> (209)
http://www.selleckchem.com/products/pd-0332991-palbociclib-isethionate.html

$$$$
VER155008.cdx
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M  END
>  <Mol_ID> (210)
2945

>  <Formula> (210)
C25H23Cl2N7O4

>  <MolWeight> (210)
556.40062

>  <Cat> (210)
S7751

>  <Name> (210)
VER155008

>  <Synonyms> (210)
C07

>  <Target> (210)
HSP (e.g. HSP90)

>  <Form> (210)
Free Base

>  <CAS> (210)
1134156-31-2

>  <URL> (210)
http://www.selleckchem.com/products/ver155008.html

$$$$
GDC-0973(XL518,RG7420.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (211)
2953

>  <Formula> (211)
C21H21F3IN3O2

>  <MolWeight> (211)
531.3100196

>  <Cat> (211)
S8041

>  <Name> (211)
Cobimetinib (GDC-0973, RG7420)

>  <Synonyms> (211)
XL518

>  <Target> (211)
MEK

>  <Form> (211)
Free Base

>  <CAS> (211)
934660-93-2

>  <URL> (211)
http://www.selleckchem.com/products/cobimetinib-gdc-0973-rg7420.html

$$$$
BPTES.cdx
csChFnd80/05071910222D

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BPTES

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N/A

>  <Target> (212)
Glutaminase

>  <Form> (212)
Free Base

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314045-39-1

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

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CPI-360

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N/A

>  <Target> (213)
Histone Methyltransferase

>  <Form> (213)
Free Base

>  <CAS> (213)
1802175-06-9

>  <URL> (213)
http://www.selleckchem.com/products/cpi-360.html

$$$$
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N/A

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GSK-3

>  <Form> (214)
Free Base

>  <CAS> (214)
667463-85-6

>  <URL> (214)
http://www.selleck.cn/products/bio-acetoxime.html

$$$$
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SirReal2

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Sirtuin

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Free Base

>  <CAS> (215)
709002-46-0

>  <URL> (215)
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Bcl-2

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Free Base

>  <CAS> (216)
1668553-26-1

>  <URL> (216)
http://www.selleckchem.com/products/a-1210477.html

$$$$
PFI-4.cdx
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>  <Mol_ID> (217)
3034

>  <Formula> (217)
C21H24N4O3

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S7906

>  <Name> (217)
PFI-4

>  <Synonyms> (217)
N/A

>  <Target> (217)
Epigenetic Reader Domain

>  <Form> (217)
Free Base

>  <CAS> (217)
900305-37-5

>  <URL> (217)
http://www.selleckchem.com/products/pfi-4.html

$$$$
ORY-1001.cdx
csChFnd80/05071910222D

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3051

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C15H24Cl2N2

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ORY-1001 (RG-6016) 2HCl

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N/A

>  <Target> (218)
Histone Demethylase

>  <Form> (218)
Dihydrochloride

>  <CAS> (218)
1431326-61-2

>  <URL> (218)
http://www.selleckchem.com/products/ory-1001-rg-6016.html

$$$$
VX-11e (VTX-11e, Vertex-11e).cdx
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>  <Mol_ID> (219)
3063

>  <Formula> (219)
C24H20Cl2FN5O2

>  <MolWeight> (219)
500.3523032

>  <Cat> (219)
S7709

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VX-11e

>  <Synonyms> (219)
VTX-11e, Vertex-11e

>  <Target> (219)
ERK

>  <Form> (219)
Free Base

>  <CAS> (219)
896720-20-0

>  <URL> (219)
http://www.selleckchem.com/products/vx-11e.html

$$$$
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1419949-20-4

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1228013-30-6

>  <URL> (221)
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256373-96-3

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>  <Mol_ID> (224)
3111

>  <Formula> (224)
C25H28N6O

>  <MolWeight> (224)
428.52942

>  <Cat> (224)
S7767

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AZ6102

>  <Synonyms> (224)
AZ-6102

>  <Target> (224)
PPAR

>  <Form> (224)
Free Base

>  <CAS> (224)
1645286-75-4

>  <URL> (224)
http://www.selleckchem.com/products/az6102.html

$$$$
ICI-118551(ICI-118,551).cdx
csChFnd80/05071910222D

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>  <Mol_ID> (225)
3116

>  <Formula> (225)
C17H28ClNO2

>  <MolWeight> (225)
313.86272

>  <Cat> (225)
S8114

>  <Name> (225)
ICI-118551(ICI-118,551) hydrochloride

>  <Synonyms> (225)
ICI-118,551

>  <Target> (225)
Adrenergic Receptor

>  <Form> (225)
Hydrochloride

>  <CAS> (225)
1217094-53-5

>  <URL> (225)
http://www.selleckchem.com/products/ici-118551-ici-118-551.html

$$$$
PF-CBP1.cdx
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>  <Mol_ID> (226)
3118

>  <Formula> (226)
C29H37ClN4O3

>  <MolWeight> (226)
525.08208

>  <Cat> (226)
S8180

>  <Name> (226)
PF-CBP1 HCL

>  <Synonyms> (226)
N/A

>  <Target> (226)
Epigenetic Reader Domain

>  <Form> (226)
Hydrochloride

>  <URL> (226)
http://www.selleckchem.com/products/pf-cbp1.html

$$$$
I-BRD9 (GSK602).cdx
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M  END
>  <Mol_ID> (227)
3127

>  <Formula> (227)
C22H22F3N3O3S2

>  <MolWeight> (227)
497.5535896

>  <Cat> (227)
S7835

>  <Name> (227)
I-BRD9 (GSK602)

>  <Synonyms> (227)
GSK602

>  <Target> (227)
Epigenetic Reader Domain

>  <Form> (227)
Free Base

>  <CAS> (227)
1714146-59-4

>  <URL> (227)
http://www.selleckchem.com/products/i-brd9-gsk602.html

$$$$
SB366791.cdx
csChFnd80/05071910222D

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TRPV

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472981-92-3

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http://www.selleckchem.com/products/sb366791.html

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Raf

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1393465-84-3

>  <URL> (229)
http://www.selleckchem.com/products/plx7904.html

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JNK

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883065-90-5

>  <URL> (230)
http://www.selleckchem.com/products/bi-78d3.html

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Histone Methyltransferase

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1527503-11-2

>  <URL> (231)
http://www.selleckchem.com/products/a-366.html

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1254036-66-2

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http://www.selleckchem.com/products/gsk2292767.html

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c-Met

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1173699-31-4

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http://www.selleckchem.com/products/amg-337.html

$$$$
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Caspase

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Free Base

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1448428-04-3

>  <URL> (234)
http://www.selleckchem.com/products/selonsertib-gs-4997.html

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C28H28ClN3O3

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SIS3 HCl

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TGF-beta/Smad

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hydrochloride

>  <CAS> (235)
521984-48-5

>  <URL> (235)
http://www.selleckchem.com/products/sis3.html

$$$$
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M  END
>  <Mol_ID> (236)
3239

>  <Formula> (236)
C17H11KN2O6S2

>  <MolWeight> (236)
442.50734

>  <Cat> (236)
S8327

>  <Name> (236)
KYA1797K

>  <Synonyms> (236)
N/A

>  <Target> (236)
Wnt/beta-catenin

>  <Form> (236)
potassium salt

>  <CAS> (236)
1956356-56-1

>  <URL> (236)
http://www.selleckchem.com/products/kya1797k.html

$$$$
BAY-61-3606.cdx
csChFnd80/05071910222D

 31 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (237)
3242

>  <Formula> (237)
C20H20Cl2N6O3

>  <MolWeight> (237)
463.3172

>  <Cat> (237)
S7006

>  <Name> (237)
BAY-61-3606

>  <Synonyms> (237)
N/A

>  <Target> (237)
Syk

>  <Form> (237)
dihydrochloride

>  <CAS> (237)
648903-57-5

>  <URL> (237)
http://www.selleckchem.com/products/bay-61-3606.html

$$$$
LOXO-101.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (238)
3245

>  <Formula> (238)
C21H24F2N6O6S

>  <MolWeight> (238)
526.5136664

>  <Cat> (238)
S7960

>  <Name> (238)
LOXO-101(sulfate)

>  <Synonyms> (238)
N/A

>  <Target> (238)
Trk receptor

>  <Form> (238)
sulfate

>  <CAS> (238)
1223405-08-0

>  <URL> (238)
http://www.selleckchem.com/products/loxo-101.html

$$$$
LLY507.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (239)
3253

>  <Formula> (239)
C36H42N6O

>  <MolWeight> (239)
574.75828

>  <Cat> (239)
S7575

>  <Name> (239)
LLY-507

>  <Synonyms> (239)
N/A

>  <Target> (239)
Histone Methyltransferase

>  <Form> (239)
Free Base

>  <CAS> (239)
1793053-37-8

>  <URL> (239)
http://www.selleckchem.com/products/lly-507.html

$$$$
CPI-637.cdx
csChFnd80/05071910222D

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BDA-366

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N/A

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Bcl-2

>  <Form> (241)
Free Base

>  <CAS> (241)
1909226-00-1

>  <URL> (241)
http://www.selleckchem.com/products/bda-366.html

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untitled.cdx
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E3 Ligase

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1313363-54-0

>  <URL> (242)
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$$$$
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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
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  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
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 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
 16 18  1  0  0  0  0
 15 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 20  1  0  0  0  0
 22 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
  1 29  1  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  1  0  0  0  0
 33 34  1  0  0  0  0
 34 30  1  0  0  0  0
 32 35  1  0  0  0  0
 32 36  1  0  0  0  0
M  END
>  <Mol_ID> (243)
3287

>  <Formula> (243)
C26H24N8O2

>  <MolWeight> (243)
480.52116

>  <Cat> (243)
S8362

>  <Name> (243)
ARRY-380 (ONT-380)

>  <Synonyms> (243)
Tucatinib

>  <Target> (243)
HER2

>  <Form> (243)
Free Base

>  <CAS> (243)
937263-43-9

>  <URL> (243)
http://www.selleckchem.com/products/arry-380-ont-380.html

$$$$
EPZ020411.cdx
csChFnd80/05071910222D

 34 35  0  0  0  0  0  0  0  0999 V2000
   16.2085    4.6406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9085    3.4282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3085    3.4282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0085    4.6406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3085    5.8531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9085    5.8531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0085    2.2157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4391    0.9368    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.4795    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.6919    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4008    2.0694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3376    3.1098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7070    2.8187    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.1396    1.4873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.6438    3.8591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.0132    3.5681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.9500    4.6085    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   27.3194    4.3174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2085    7.0655    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8085    7.0655    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.8185    8.0554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8286    7.0655    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.8185    6.0755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4286    7.0655    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7286    8.2779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3286    8.2779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6286    9.4904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3286   10.7028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6286   11.9152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2286   11.9152    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5286   10.7028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2286    9.4904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7222   27.4593    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   27.4593    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
  3  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11  7  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  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
  6 19  1  0  0  0  0
 20 19  1  1  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 20  1  0  0  0  0
 22 24  1  6  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 27  1  0  0  0  0
M  END
>  <Mol_ID> (244)
3322

>  <Formula> (244)
C25H40Cl2N4O3

>  <MolWeight> (244)
515.5161

>  <Cat> (244)
S7820

>  <Name> (244)
EPZ020411 2HCl

>  <Synonyms> (244)
N/A

>  <Target> (244)
Histone Methyltransferase

>  <Form> (244)
dihydrochloride

>  <CAS> (244)
1700663-41-7(free base)

>  <URL> (244)
http://www.selleckchem.com/products/epz020411.html

$$$$
VPS34 inhibitor 1.cdx
csChFnd80/05071910222D

 29 32  0  0  0  0  0  0  0  0999 V2000
    0.0000    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.9000    0.0000 N   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
    2.4249    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    7.0000    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
    1.2124    2.8000    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
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    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
    6.0622    7.0000    0.0000 N   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
    4.8497    9.1000    0.0000 N   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
    2.4249    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    9.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1249   11.7124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7249   11.7124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9995   10.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3995   10.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  5  7  1  0  0  0  0
  3  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
  7 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19  7  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 17 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
 21 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 21  1  0  0  0  0
 24 28  1  0  0  0  0
 24 29  1  0  0  0  0
M  END
>  <Mol_ID> (245)
3331

>  <Formula> (245)
C21H25N7O

>  <MolWeight> (245)
391.4695

>  <Cat> (245)
S8456

>  <Name> (245)
VPS34 inhibitor 1 (Compound 19, PIK-III anal

>  <Synonyms> (245)
N/A

>  <Target> (245)
PI3K

>  <Form> (245)
Free Base

>  <CAS> (245)
1383716-46-8

>  <URL> (245)
http://www.selleckchem.com/products/vps34-inhibitor-1.html

$$$$
Urokinase inhibitor 1.cdx
csChFnd80/05071910222D

 26 26  0  0  0  0  0  0  0  0999 V2000
    6.0622    3.5000    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
    7.2746    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    3.5000    0.0000 C   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
    9.6995    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    3.5000    0.0000 N   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
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    1.2124    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4148    3.2101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    5.6000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.6356    1.3566    0.0000 Cl  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
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
 10 11  1  0  0  0  0
  7 12  1  0  0  0  0
  1 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  1  0  0  0  0
 17 18  1  0  0  0  0
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 18 20  1  0  0  0  0
 17 21  1  0  0  0  0
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 11 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
M  END
>  <Mol_ID> (246)
3342

>  <Formula> (246)
C14H17Cl2N5O4S

>  <MolWeight> (246)
422.28688

>  <Cat> (246)
S8457

>  <Name> (246)
UK-371804 HCl

>  <Synonyms> (246)
UK-371804 HCl

>  <Target> (246)
Serine Protease

>  <Form> (246)
hydrochloride

>  <CAS> (246)
256476-36-5

>  <URL> (246)
http://www.selleckchem.com/products/uk-371804-hcl.html

$$$$
Thiomyristoyl.cdx
csChFnd80/05071910222D

 41 42  0  0  0  0  0  0  0  0999 V2000
    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
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    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
    4.8497    2.8000    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
    7.2746    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.7000    0.0000 O   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
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   12.1244    8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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Thiomyristoyl

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TM

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Sirtuin

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Free Base

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1429749-41-6

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

$$$$
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CDK

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Free Base

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1453834-21-3

>  <URL> (248)
http://www.selleckchem.com/products/ldc4297-ldc044297.html

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PD-166866

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N/A

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FGFR

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Free Base

>  <CAS> (249)
192705-79-6

>  <URL> (249)
http://www.selleckchem.com/products/pd-166866.html

$$$$
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FGFR

>  <Form> (250)
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>  <CAS> (250)
1707289-21-1

>  <URL> (250)
http://www.selleckchem.com/products/blu-554.html

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1821908-48-8

>  <URL> (256)
http://www.selleckchem.com/products/sgc2085.html

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1226781-44-7

>  <URL> (257)
http://www.selleckchem.com/products/omarigliptin-mk-3102.html

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1693758-51-8

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1268454-23-4

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761423-87-4

>  <URL> (264)
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Chk2

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free base

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516480-79-8

>  <URL> (265)
http://www.selleckchem.com/products/chk2-inhibitor-2-bml-277.html

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ERK1,ERK2

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1951483-29-6

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http://www.selleckchem.com/products/ly3214996.html

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1243245-18-2

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ATR

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hydrochloride

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1876467-74-1(free base)

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M  END
>  <Mol_ID> (277)
3626

>  <Formula> (277)
C16H20Cl3N5

>  <MolWeight> (277)
388.7225

>  <Cat> (277)
S8278

>  <Name> (277)
SHP099 hydrochloride

>  <Synonyms> (277)
N/A

>  <Target> (277)
phosphatase

>  <Form> (277)
hydrochloride 

>  <CAS> (277)
1801747-42-1(free base)

>  <URL> (277)
http://selleckchem.com/products/shp099-dihydrochloride.html

$$$$
S5063 Trelagliptin succinate.cdx
csChFnd80/05071910222D

 34 35  0  0  0  0  0  0  0  0999 V2000
    6.0622    3.5000    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
    7.2746    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    3.5000    0.0000 C   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
    4.8497    4.2000    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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 11 12  1  0  0  0  0
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 13 14  1  0  0  0  0
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  8  9  3  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
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 30 31  1  0  0  0  0
 28 32  2  0  0  0  0
 31 33  1  0  0  0  0
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M  END
>  <Mol_ID> (278)
3634

>  <Formula> (278)
C22H26FN5O6

>  <MolWeight> (278)
475.4701432

>  <Cat> (278)
S5063

>  <Name> (278)
Trelagliptin succinate

>  <Synonyms> (278)
N/A

>  <Target> (278)
DPP-4

>  <Form> (278)
succinate

>  <CAS> (278)
1029877-94-8

>  <URL> (278)
http://selleckchem.com/products/trelagliptin-succinate.html

$$$$
S5074 Argatroban Monohydrate.cdx
csChFnd80/05071910222D

 36 37  0  0  0  0  0  0  0  0999 V2000
    8.4871    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    5.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.4951    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    6.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    6.9951    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    5.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  7  1  0  0  0  0
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  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
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 15 10  1  6  0  0  0
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 18 22  1  0  0  0  0
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 21 24  1  0  0  0  0
 21 25  1  6  0  0  0
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 31 34  2  0  0  0  0
 14 36  1  0  0  0  0
M  END
>  <Mol_ID> (279)
3666

>  <Formula> (279)
C23H38N6O6S

>  <MolWeight> (279)
526.64942

>  <Cat> (279)
S5074

>  <Name> (279)
Argatroban Monohydrate

>  <Synonyms> (279)
Argatroban hydrate, Argipidine

>  <Target> (279)
Thrombin

>  <CAS> (279)
141396-28-3

>  <URL> (279)
http://selleckchem.com/products/argatroban-monohydrate.html

$$$$
S5079 Sitagliptin.cdx
csChFnd80/05071910222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   13.4915    2.6547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1394    3.0969    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1394    4.4721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.7253    4.4708    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5129    5.1708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9335    5.1683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3005    4.4708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6632    5.1708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 12  2  1  0  0  0  0
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 22  6  1  0  0  0  0
 23  6  1  0  0  0  0
 24  6  1  0  0  0  0
  7 18  1  0  0  0  0
  8  7  1  0  0  0  0
  9  7  1  0  0  0  0
 10  8  1  0  0  0  0
 20  8  2  0  0  0  0
 21 10  1  0  0  0  0
 11 19  1  0  0  0  0
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M  END
>  <Mol_ID> (280)
3669

>  <Formula> (280)
C16H15F6N5O

>  <MolWeight> (280)
407.3136192

>  <Cat> (280)
S5079

>  <Name> (280)
Sitagliptin

>  <Synonyms> (280)
MK-0431

>  <Target> (280)
DPP-4

>  <Form> (280)
free base

>  <CAS> (280)
486460-32-6

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

$$$$
Skp2 inhibitor C1 (SKPin C1).cdx
csChFnd80/05071910222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    4.9401    3.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3255    2.3595    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.3318    1.3862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (281)
3685

>  <Formula> (281)
C18H13BrN2O4S2

>  <MolWeight> (281)
465.34082

>  <Cat> (281)
S8652

>  <Name> (281)
Skp2 inhibitor C1 (SKPin C1)

>  <Synonyms> (281)
N/A

>  <Target> (281)
CDK

>  <CAS> (281)
432001-69-9

>  <URL> (281)
http://selleckchem.com/products/skp2-inhibitor-c1-skpin-c1.html

$$$$
Tenalisib (RP6530).cdx
csChFnd80/05071910222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (282)
3703

>  <Formula> (282)
C23H18FN5O2

>  <MolWeight> (282)
415.4197232

>  <Cat> (282)
S8672

>  <Name> (282)
Tenalisib (RP6530)

>  <Synonyms> (282)
N/A

>  <Target> (282)
PI3K

>  <Form> (282)
free base

>  <CAS> (282)
1639417-53-0

>  <URL> (282)
http://selleckchem.com/products/tenalisib-rp6530.html

$$$$
S5245 Raltegravir potassium.cdx
csChFnd80/05071910222D

 33 34  0  0  0  0  0  0  0  0999 V2000
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 11  3  1  0  0  0  0
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M  END
>  <Mol_ID> (283)
3727

>  <Formula> (283)
C20H20FKN6O5

>  <MolWeight> (283)
482.5067032

>  <Cat> (283)
S5245

>  <Name> (283)
Raltegravir potassium

>  <Synonyms> (283)
N/A

>  <Target> (283)
Integrase,HIV Protease

>  <Form> (283)
potassium salt

>  <CAS> (283)
871038-72-1

>  <URL> (283)
http://selleckchem.com/products/raltegravir-potassium.html

$$$$
Cu-CPT22.cdx
csChFnd80/05071910222D

 26 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (284)
3733

>  <Formula> (284)
C19H22O7

>  <MolWeight> (284)
362.37378

>  <Cat> (284)
S8677

>  <Name> (284)
Cu-CPT22

>  <Synonyms> (284)
N/A

>  <Target> (284)
TLR

>  <Form> (284)
free base

>  <CAS> (284)
1416324-85-0

>  <URL> (284)
http://selleckchem.com/products/cu-cpt22.html

$$$$
S5402 Dasabuvir(ABT-333).cdx
csChFnd80/05071910222D

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HCV Protease

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free base

>  <CAS> (285)
1132935-63-7

>  <URL> (285)
http://selleckchem.com/products/dasabuvir-abt-333.html

$$$$
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ATM/ATR

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free base

>  <CAS> (286)
2089288-03-7

>  <URL> (286)
http://selleckchem.com/products/azd1390.html

$$$$
GSK'963.cdx
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230.30552

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GSK'963

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N/A

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NF-¦ÊB,TNF-alpha

>  <Form> (287)
free base

>  <CAS> (287)
2049868-46-2

>  <URL> (287)
http://selleckchem.com/products/gsk963.html

$$$$
bpV (HOpic).cdx
csChFnd80/05071910222D

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C6H4K2NO8V

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bpV (HOpic)

>  <Synonyms> (288)
Bisperoxovanadium(HOpic)

>  <Target> (288)
PTEN

>  <Form> (288)
potassium 

>  <CAS> (288)
722494-26-0

>  <URL> (288)
http://selleckchem.com/products/bpv-hopic.html

$$$$
FGF401.cdx
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FGF401

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N/A

>  <Target> (289)
FGFR

>  <Form> (289)
free base

>  <CAS> (289)
1708971-55-4

>  <URL> (289)
http://selleckchem.com/products/fgf401.html

$$$$
S5069 Dabrafenib Mesylate.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (290)
3866

>  <Formula> (290)
C24H24F3N5O5S3

>  <MolWeight> (290)
615.6680696

>  <Cat> (290)
S5069

>  <Name> (290)
Dabrafenib Mesylate

>  <Synonyms> (290)
GSK2118436 Mesylate

>  <Target> (290)
Raf

>  <Form> (290)
mesylate

>  <CAS> (290)
1195768-06-9

>  <URL> (290)
http://selleckchem.com/products/dabrafenib-mesylate.html

$$$$
S5566 Dapagliflozin propanediol monohydrate.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (291)
4000

>  <Formula> (291)
C24H35ClO9

>  <MolWeight> (291)
502.9823

>  <Cat> (291)
S5566

>  <Name> (291)
Dapagliflozin propanediol monohydrate

>  <Synonyms> (291)
N/A

>  <Target> (291)
SGLT

>  <Form> (291)
monohydrate

>  <CAS> (291)
960404-48-2

>  <URL> (291)
http://selleckchem.com/products/dapagliflozin-propanediol-monohydrate.html

$$$$
S5413 Ertugliflozin.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (292)
4073

>  <Formula> (292)
C22H25ClO7

>  <MolWeight> (292)
436.8827

>  <Cat> (292)
S5413

>  <Name> (292)
Ertugliflozin

>  <Synonyms> (292)
PF-04971729?

>  <Target> (292)
SGLT2

>  <Form> (292)
free base

>  <CAS> (292)
1210344-57-2

>  <URL> (292)
http://selleckchem.com/products/.html

$$$$
CCT245737.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (293)
4087

>  <Formula> (293)
C16H16F3N7O

>  <MolWeight> (293)
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>  <Cat> (293)
S8253

>  <Name> (293)
CCT245737 

>  <Synonyms> (293)
N/A

>  <Target> (293)
Chk

>  <Form> (293)
free base

>  <CAS> (293)
1489389-18-5

>  <URL> (293)
http://www.selleckchem.com/products/cct245737.html

$$$$
S5623 Bedaquiline.cdx
csChFnd80/05071910222D

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>  <Mol_ID> (294)
4100

>  <Formula> (294)
C32H31BrN2O2

>  <MolWeight> (294)
555.50474

>  <Cat> (294)
S5623

>  <Name> (294)
Bedaquiline

>  <Synonyms> (294)
TMC207; R207910

>  <Target> (294)
tuberculosis

>  <Form> (294)
free base

>  <CAS> (294)
843663-66-1

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

$$$$
Lazertinib (YH25448,GNS-1480).cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (295)
4103

>  <Formula> (295)
C30H34N8O3

>  <MolWeight> (295)
554.64276

>  <Cat> (295)
S8724

>  <Name> (295)
Lazertinib (YH25448,GNS-1480)

>  <Form> (295)
free base

>  <CAS> (295)
1903008-80-9

$$$$
S9360 4-Hydroxyquinazoline.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (296)
4144

>  <Formula> (296)
C8H6N2O

>  <MolWeight> (296)
146.14604

>  <Cat> (296)
S9360

>  <Name> (296)
4-Hydroxyquinazoline

>  <Form> (296)
free base

>  <CAS> (296)
491-36-1

$$$$
S9500 Valbenazine tosylate.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (297)
4529

>  <Formula> (297)
C38H54N2O10S2

>  <MolWeight> (297)
762.97276

>  <Cat> (297)
S9500

>  <Name> (297)
Valbenazine tosylate

>  <Form> (297)
free base

>  <CAS> (297)
1639208-54-0

$$$$
GI254023X.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (298)
4662

>  <Formula> (298)
C21H33N3O4

>  <MolWeight> (298)
391.50442

>  <Cat> (298)
S8660

>  <Name> (298)
GI254023X

>  <Synonyms> (298)
GI 4023

>  <Target> (298)
Immunology & Inflammation related

>  <Form> (298)
free base

>  <CAS> (298)
260264-93-5

>  <URL> (298)
http://selleckchem.com/products/gi254023x.html

$$$$
S5476 Rolapitant.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (299)
4678

>  <Formula> (299)
C25H26F6N2O2

>  <MolWeight> (299)
500.4765592

>  <Cat> (299)
S5476

>  <Name> (299)
Rolapitant

>  <Target> (299)
NK1-receptor

>  <CAS> (299)
552292-08-7

>  <URL> (299)
https://www.selleckchem.com/products/rolapitant.html

$$$$
S5667 Fruquintinib.cdx
csChFnd80/05071910222D

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M  END
>  <Mol_ID> (300)
4681

>  <Formula> (300)
C21H19N3O5

>  <MolWeight> (300)
393.39266

>  <Cat> (300)
S5667

>  <Name> (300)
Fruquintinib

>  <Target> (300)
VEGFRs

>  <CAS> (300)
1194506-26-7

>  <URL> (300)
https://www.selleckchem.com/products/fruquintinib.html

$$$$

csChFnd80/05071910222D

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M  END
>  <Mol_ID> (301)
4755

>  <Formula> (301)
C16H16N4O2S2

>  <MolWeight> (301)
360.45384

>  <Cat> (301)
S5696

>  <Name> (301)
JNJ0966

>  <Synonyms> (301)
N/A

>  <Target> (301)
Others

>  <Form> (301)
Free Base

>  <CAS> (301)
315705-75-0

>  <URL> (301)
http://www.selleckchem.com/products/jnj0966.html

$$$$

csChFnd80/05071910222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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  1 10  1  0  0  0  0
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M  END
>  <Mol_ID> (302)
4836

>  <Formula> (302)
C21H16FN7O

>  <MolWeight> (302)
401.3964432

>  <Cat> (302)
S5818

>  <Name> (302)
acalisib (GS-9820)

>  <Synonyms> (302)
CAL-120

>  <Target> (302)
PI3K

>  <Form> (302)
Free Base

>  <CAS> (302)
870281-34-8

>  <URL> (302)
http://www.selleckchem.com/products/acalisib-gs-9820.html

$$$$

csChFnd80/05071910222D

 16 16  0  0  0  0  0  0  0  0999 V2000
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  2  5  1  0  0  0  0
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M  END
>  <Mol_ID> (303)
4855

>  <Formula> (303)
C9H12N2O4S

>  <MolWeight> (303)
244.26758

>  <Cat> (303)
S5837

>  <Name> (303)
BRL-50481

>  <Synonyms> (303)
N/A

>  <Target> (303)
PDE

>  <Form> (303)
Free Base

>  <CAS> (303)
433695-36-4

>  <URL> (303)
http://www.selleckchem.com/products/brl-50481.html

$$$$

csChFnd80/05071910222D

 63 68  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (304)
4880

>  <Formula> (304)
C48H52F2O11S2

>  <MolWeight> (304)
907.0466864

>  <Cat> (304)
S5901

>  <Name> (304)
Canagliflozin hemihydrate

>  <Synonyms> (304)
N/A

>  <Target> (304)
SGLT

>  <Form> (304)
hemihydrate

>  <CAS> (304)
928672-86-0

>  <URL> (304)
http://www.selleckchem.com/products/canagliflozin-hemihydrate.html

$$$$

csChFnd80/05071910222D

 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> (305)
4882

>  <Formula> (305)
C16H15N3O3

>  <MolWeight> (305)
297.3086

>  <Cat> (305)
S5903

>  <Name> (305)
JANEX-1

>  <Synonyms> (305)
WHI-P131

>  <Target> (305)
JAK

>  <Form> (305)
Free Base

>  <CAS> (305)
202475-60-3

>  <URL> (305)
http://www.selleckchem.com/products/janex-1.html

$$$$

csChFnd80/05071910222D

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M  END
>  <Mol_ID> (306)
4888

>  <Formula> (306)
C19H25N7O2

>  <MolWeight> (306)
383.4475

>  <Cat> (306)
S5909

>  <Name> (306)
Anagliptin

>  <Synonyms> (306)
N/A

>  <Target> (306)
DPP-4

>  <Form> (306)
Free Base

>  <CAS> (306)
739366-20-2

>  <URL> (306)
http://www.selleckchem.com/products/anagliptin.html

$$$$

csChFnd80/05071910222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (307)
4893

>  <Formula> (307)
C22H26N4O3

>  <MolWeight> (307)
394.46684

>  <Cat> (307)
S5916

>  <Name> (307)
GSK 5959

>  <Synonyms> (307)
N/A

>  <Target> (307)
Epigenetic Reader Do

>  <Form> (307)
Free Base

>  <CAS> (307)
901245-65-6

>  <URL> (307)
http://www.selleckchem.com/products/gsk-5959.html

$$$$

csChFnd80/05071910222D

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M  END
>  <Mol_ID> (308)
4901

>  <Formula> (308)
C17H27Cl2NO

>  <MolWeight> (308)
332.30838

>  <Cat> (308)
S5926

>  <Name> (308)
Pitolisant hydrochloride

>  <Synonyms> (308)
Tiprolisant hydrochloride, BF-2649 HCl

>  <Target> (308)
Histamine Receptor

>  <Form> (308)
hydrochloride

>  <CAS> (308)
903576-44-3

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

$$$$

csChFnd80/05071910222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (309)
4907

>  <Formula> (309)
C13H15N3O2S

>  <MolWeight> (309)
277.3421

>  <Cat> (309)
S5933

>  <Name> (309)
K 858

>  <Synonyms> (309)
N/A

>  <Target> (309)
Kinesin

>  <Form> (309)
Free Base

>  <CAS> (309)
72926-24-0

>  <URL> (309)
http://www.selleckchem.com/products/k858.html

$$$$

csChFnd80/05071910222D

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M  END
>  <Mol_ID> (310)
4918

>  <Formula> (310)
C24H28N4O3

>  <MolWeight> (310)
420.50412

>  <Cat> (310)
S8556

>  <Name> (310)
AZ31

>  <Synonyms> (310)
N/A

>  <Target> (310)
ATM/ATR

>  <Form> (310)
Free Base

>  <CAS> (310)
2088113-98-6

>  <URL> (310)
http://www.selleckchem.com/products/az31.html

$$$$

csChFnd80/05071910222D

 22 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (311)
4920

>  <Formula> (311)
C16H15FN4O

>  <MolWeight> (311)
298.3149032

>  <Cat> (311)
S8592

>  <Name> (311)
Pamiparib (BGB-290)

>  <Synonyms> (311)
N/A

>  <Target> (311)
PARP

>  <Form> (311)
Free Base

>  <CAS> (311)
1446261-44-4

>  <URL> (311)
http://www.selleckchem.com/products/bgb-290.html

$$$$

csChFnd80/05071910222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (312)
4922

>  <Formula> (312)
C13H12ClN3O2

>  <MolWeight> (312)
277.70628

>  <Cat> (312)
S8641

>  <Name> (312)
Nec-1s (7-Cl-O-Nec1)

>  <Synonyms> (312)
Necrostatin-1 stable

>  <Target> (312)
TNF-alpha

>  <Form> (312)
Free Base

>  <CAS> (312)
852391-15-2

>  <URL> (312)
http://www.selleckchem.com/products/nec-1s-7-cl-o-nec1.html

$$$$

csChFnd80/05071910222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (313)
4930

>  <Formula> (313)
C18H18FN5O2S

>  <MolWeight> (313)
387.4312232

>  <Cat> (313)
S8727

>  <Name> (313)
Atuveciclib (BAY-1143572)

>  <Synonyms> (313)
N/A

>  <Target> (313)
CDK

>  <Form> (313)
Free Base

>  <CAS> (313)
1414943-88-6

>  <URL> (313)
http://www.selleckchem.com/products/atuveciclib-bay-1143572.html

$$$$

csChFnd80/05071910222D

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>  <Mol_ID> (314)
4936

>  <Formula> (314)
C25H25F3N4O4

>  <MolWeight> (314)
502.4856096

>  <Cat> (314)
S8745

>  <Name> (314)
LXH254

>  <Synonyms> (314)
N/A

>  <Target> (314)
Raf

>  <Form> (314)
Free Base

>  <CAS> (314)
1800398-38-2

>  <URL> (314)
http://www.selleckchem.com/products/lxh254.html

$$$$

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M  END
>  <Mol_ID> (315)
4952

>  <Formula> (315)
C18H13F2N3O3S

>  <MolWeight> (315)
389.3759264

>  <Cat> (315)
S8776

>  <Name> (315)
WM-1119

>  <Synonyms> (315)
N/A

>  <Target> (315)
Histone Acetyltransf

>  <Form> (315)
Free Base

>  <CAS> (315)
2055397-28-7

>  <URL> (315)
http://www.selleckchem.com/products/wm-1119.html

$$$$

csChFnd80/05071910222D

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>  <Mol_ID> (316)
4953

>  <Formula> (316)
C25H27N5O2

>  <MolWeight> (316)
429.51418

>  <Cat> (316)
S8777

>  <Name> (316)
Evobrutinib

>  <Synonyms> (316)
M-2951, MSC-2364447C

>  <Target> (316)
BTK

>  <Form> (316)
Free Base

>  <CAS> (316)
1415823-73-2

>  <URL> (316)
http://www.selleckchem.com/products/evobrutinib.html

$$$$

csChFnd80/05071910222D

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M  END
>  <Mol_ID> (317)
4958

>  <Formula> (317)
C17H13ClN2O3

>  <MolWeight> (317)
328.74972

>  <Cat> (317)
S8813

>  <Name> (317)
LIT-927

>  <Synonyms> (317)
N/A

>  <Target> (317)
CXCR

>  <Form> (317)
Free Base

>  <CAS> (317)
2172879-52-4

>  <URL> (317)
http://www.selleckchem.com/products/lit-927.html

$$$$

csChFnd80/05071910222D

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>  <Mol_ID> (318)
5286

>  <Formula> (318)
C25H23FN8O2S2

>  <MolWeight> (318)
550.6309232

>  <Cat> (318)
S7564

>  <Name> (318)
SAR125844

>  <Synonyms> (318)
N/A

>  <Target> (318)
c-Met

>  <Form> (318)
free base

>  <CAS> (318)
1116743-46-4

>  <URL> (318)
http://www.selleck.cn/products/sar125844.html

$$$$

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free base

>  <CAS> (319)
1799711-21-9

>  <URL> (319)
http://www.selleck.cn/products/bet1.html

$$$$

csChFnd80/05071910222D

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free base

>  <CAS> (320)
2226735-55-1

>  <URL> (320)
http://www.selleck.cn/products/gsk547.html

$$$$
