untitled.cdx
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>  <Mol_ID> (1)
5

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C27H32ClN5O5

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542.02648

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S1006

>  <Name> (1)
Saracatinib (AZD0530)

>  <Synonyms> (1)
N/A 

>  <Target> (1)
Src, Bcr-Abl

>  <Form> (1)
Free Base

>  <CAS> (1)
379231-04-6

>  <URL> (1)
http://www.selleckchem.com/products/AZD0530.html

$$$$
Dasatinib.cdx
csChFnd80/05071910422D

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>  <Mol_ID> (2)
12

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C22H26ClN7O2S

>  <MolWeight> (2)
488.00554

>  <Cat> (2)
S1021

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Dasatinib

>  <Synonyms> (2)
BMS-354825

>  <Target> (2)
Src, Bcr-Abl, c-Kit

>  <Form> (2)
Free Base

>  <CAS> (2)
302962-49-8

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

$$$$

csChFnd80/05071910422D

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>  <Mol_ID> (3)
14

>  <Formula> (3)
C21H21FN6O

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392.4294432

>  <Cat> (3)
S1018

>  <Name> (3)
Dovitinib (TKI-258, CHIR-258)

>  <Synonyms> (3)
N/A

>  <Target> (3)
c-Kit, FGFR, Flt, VEGFR, PDGFR 

>  <Form> (3)
Free base

>  <CAS> (3)
405169-16-6

>  <URL> (3)
http://www.selleckchem.com/products/CHIR-258.html

$$$$
untitled.cdx
csChFnd80/05071910422D

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M  END
>  <Mol_ID> (4)
21

>  <Formula> (4)
C28H22F3N7O

>  <MolWeight> (4)
529.5157896

>  <Cat> (4)
S1033

>  <Name> (4)
Nilotinib (AMN-107)

>  <Synonyms> (4)
Tasigna 

>  <Target> (4)
Bcr-Abl

>  <Form> (4)
Free Base

>  <CAS> (4)
641571-10-0

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

$$$$
NPI2358.cdx
csChFnd80/05071910422D

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M  END
>  <Mol_ID> (5)
105

>  <Formula> (5)
C19H20N4O2

>  <MolWeight> (5)
336.3877

>  <Cat> (5)
S1176

>  <Name> (5)
NPI-2358 (Plinabulin)

>  <Synonyms> (5)
N/A

>  <Target> (5)
VDA

>  <Form> (5)
Free Base

>  <CAS> (5)
714272-27-2

>  <URL> (5)
http://www.selleckchem.com/products/NPI-2358.html

$$$$
ENMD-2076.cdx
csChFnd80/05071910422D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (6)
110

>  <Formula> (6)
C21H25N7

>  <MolWeight> (6)
375.4701

>  <Cat> (6)
S1181

>  <Name> (6)
ENMD-2076

>  <Synonyms> (6)
N/A 

>  <Target> (6)
Flt, Aurora Kinase, VEGFR

>  <Form> (6)
Tartaric Acid 

>  <CAS> (6)
934353-76-1

>  <URL> (6)
http://www.selleckchem.com/products/ENMD-2076.html

$$$$
2-Methoxyestradiol.cdx
csChFnd80/05071910422D

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M  END
>  <Mol_ID> (7)
140

>  <Formula> (7)
C19H26O3

>  <MolWeight> (7)
302.40794

>  <Cat> (7)
S1233

>  <Name> (7)
2-Methoxyestradiol

>  <Synonyms> (7)
2-ME2

>  <Target> (7)
HIF

>  <Form> (7)
Free Base

>  <CAS> (7)
362-07-2

>  <URL> (7)
http://www.selleckchem.com/products/2-Methoxyestradiol(2ME2).html

$$$$
PD173074.cdx
csChFnd80/05071910422D

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>  <Mol_ID> (8)
157

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>  <MolWeight> (8)
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219580-11-7

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HIF

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808118-40-3

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Ponatinib (AP24534)

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>  <Target> (10)
Bcr-Abl, VEGFR, FGFR, PDGFR, Flt

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943319-70-8

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Syk 

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841290-80-0

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Bcr-Abl

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Free Base

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1020172-07-9

>  <URL> (14)
http://www.selleckchem.com/products/dcc-2036.html

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1000669-72-6

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DNA/RNA Synthesis

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486-35-1

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841290-81-1

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Src

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901119-35-5

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>  <Target> (20)
FAK

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Benzenesulfonic

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939791-38-5

>  <URL> (20)
http://www.selleckchem.com/products/pf-00562271.html

$$$$
KX2-391.cdx
csChFnd80/05071910422D

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KX2-391

>  <Synonyms> (21)
N/A

>  <Target> (21)
Src

>  <Form> (21)
Free Base

>  <CAS> (21)
897016-82-9

>  <URL> (21)
http://www.selleckchem.com/products/kx2-391.html

$$$$

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>  <Mol_ID> (22)
969

>  <Formula> (22)
C27H33FN6O7

>  <MolWeight> (22)
572.5853232

>  <Cat> (22)
S2769 

>  <Name> (22)
Dovitinib Dilactic acid (TKI258 Dilactic aci

>  <Synonyms> (22)
CHIR-258 Dilactic acid 

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

>  <Form> (22)
Dilactic Acid 

>  <CAS> (22)
852433-84-2

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

$$$$
Piceatannol.cdx
csChFnd80/05071910422D

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>  <Mol_ID> (23)
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>  <Formula> (23)
C14H12O4

>  <MolWeight> (23)
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>  <Cat> (23)
S3026 

>  <Name> (23)
Piceatannol

>  <Synonyms> (23)
N/A 

>  <Target> (23)
Others

>  <Form> (23)
Free Base

>  <CAS> (23)
10083-24-6

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

$$$$
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csChFnd80/05071910422D

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129497-78-5

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1035270-39-3

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>  <Mol_ID> (32)
1543

>  <Formula> (32)
C25H31N7O6

>  <MolWeight> (32)
525.55694

>  <Cat> (32)
S2018

>  <Name> (32)
ENMD-2076 L-(+)-Tartaric acid

>  <Synonyms> (32)
N/A

>  <Target> (32)
FLT3

>  <Form> (32)
Free Base

>  <CAS> (32)
1291074-87-7

>  <URL> (32)
http://www.selleckchem.com/products/enmd-2076-l-tartaric-acid.html

$$$$
Nolvadex (Tamoxifen Citrate).cdx
csChFnd80/05071910422D

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M  END
>  <Mol_ID> (33)
1564

>  <Formula> (33)
C32H37NO8

>  <MolWeight> (33)
563.63808

>  <Cat> (33)
S1238

>  <Name> (33)
Tamoxifen

>  <Synonyms> (33)
10540-29-1

>  <Target> (33)
Estrogen/progestogen Receptor

>  <Form> (33)
Free Base

>  <CAS> (33)
ICI 46474

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

$$$$
S4667 Lidocaine hydrochloride.cdx
csChFnd80/05071910422D

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>  <Mol_ID> (34)
1690

>  <Formula> (34)
C14H23ClN2O

>  <MolWeight> (34)
270.79822

>  <Cat> (34)
S4667

>  <Name> (34)
Lidocaine hydrochloride

>  <Synonyms> (34)
	Lidocaine HCL, Lidothesin, Lignocaine hydrochloride, Xyloneural

>  <Target> (34)
Others

>  <Form> (34)
hydrochloride

>  <CAS> (34)
73-78-9

>  <URL> (34)
http://www.selleckchem.com/products/lidocaine-hydrochloride.html

$$$$
NS-187.cdx
csChFnd80/05071910422D

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M  END
>  <Mol_ID> (35)
1746

>  <Formula> (35)
C30H31F3N8O

>  <MolWeight> (35)
576.6153496

>  <Cat> (35)
S1369

>  <Name> (35)
Bafetinib (INNO-406)

>  <Synonyms> (35)
NS-187

>  <Target> (35)
Abl,Lyn

>  <Form> (35)
Free Base

>  <CAS> (35)
859212-16-1

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

$$$$
S3609 Berbamine (dihydrochloride).cdx
csChFnd80/05071910422D

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M  END
>  <Mol_ID> (36)
1749

>  <Formula> (36)
C37H42Cl2N2O6

>  <MolWeight> (36)
681.64518

>  <Cat> (36)
S3609

>  <Name> (36)
Berbamine (dihydrochloride)

>  <Synonyms> (36)
N/A

>  <Target> (36)
NF-¦ÊB,bcr/abl

>  <Form> (36)
dihydrochloride

>  <CAS> (36)
6078-17-7

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

$$$$
Cinchonine.cdx
csChFnd80/05071910422D

 24 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (37)
1869

>  <Formula> (37)
C19H22N2O

>  <MolWeight> (37)
294.39078

>  <Cat> (37)
S2283

>  <Synonyms> (37)
N/A

>  <Target> (37)
Others

>  <Form> (37)
free base

>  <CAS> (37)
118-10-5

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

$$$$
Solanesol.cdx
csChFnd80/05071910422D

 46 45  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (38)
1887

>  <Formula> (38)
C45H74O

>  <MolWeight> (38)
631.06846

>  <Cat> (38)
S2360

>  <Name> (38)
Solanesol (Nonaisoprenol)

>  <Synonyms> (38)
Nonaisoprenol, Betulanonaprenol

>  <Target> (38)
FAK

>  <Form> (38)
free base

>  <CAS> (38)
13190-97-1

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

$$$$
untitled.cdx
csChFnd80/05071910422D

 41 45  0  0  0  0  0  0  0  0999 V2000
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C31H42N6O4

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Tandutinib (MLN518)

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>  <Target> (39)
Flt

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Free Base

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387867-13-2

>  <URL> (39)
http://www.selleckchem.com/products/Tandutinib-(MLN518).html

$$$$
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TCS 359

>  <Synonyms> (40)
N/A

>  <Target> (40)
FLT3

>  <Form> (40)
Free Base

>  <CAS> (40)
301305-73-7

>  <URL> (40)
http://www.selleckchem.com/products/tcs-359.html

$$$$
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>  <MolWeight> (41)
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N/A

>  <Target> (41)
PI3K

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1201438-56-3

>  <URL> (41)
http://www.selleckchem.com/products/ipi-145-ink1197.html

$$$$
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R935788 (Fostamatinib disodium)

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N/A 

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Syk

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Sodium Salt

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1025687-58-4

>  <URL> (42)
http://www.selleckchem.com/products/R788(Fostamatinib-disodium).html

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C15H16ClN5

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PP2

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Src

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Free Base

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172889-27-9

>  <URL> (43)
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PRT062607 (P505-15, PRT2607, BIIB057) HCl

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N/A

>  <Target> (44)
Syk

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Hydrochloride

>  <CAS> (44)
1370261-97-4,1370261-96-3(free base)

>  <URL> (44)
https://www.selleckchem.com/products/prt062607-p505-15-hcl.html

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2456

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C16H19N5

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PP1

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Src

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Free Base

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172889-26-8

>  <URL> (45)
http://www.selleckchem.com/products/pp1.html

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GZD824 Dimesylate 

>  <Synonyms> (46)
N/A

>  <Target> (46)
Bcr-Abl

>  <Form> (46)
Mesylate

>  <CAS> (46)
1421783-64-3

>  <URL> (46)
http://www.selleckchem.com/products/gzd824.html

$$$$
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SSR

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FGFR

>  <Form> (47)
Free Base

>  <CAS> (47)
848318-25-2

>  <URL> (47)
http://www.selleckchem.com/products/ssr128129e.html

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2621

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C22H22FN5O3

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S7173

>  <Name> (48)
CC-292 (AVL-292)

>  <Synonyms> (48)
CC-292

>  <Target> (48)
BTK

>  <Form> (48)
Free Base

>  <CAS> (48)
1202757-89-8

>  <URL> (48)
http://www.selleckchem.com/products/avl-292.html

$$$$
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>  <Mol_ID> (49)
2630

>  <Formula> (49)
C21H21ClF3N7O3S

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>  <Name> (49)
PF-562271 HCl

>  <Synonyms> (49)
N/A

>  <Target> (49)
FAK

>  <Form> (49)
Hydrochloride

>  <URL> (49)
http://www.selleckchem.com/products/pf-562271-hcl.html

$$$$
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HIF

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Free Base

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1227158-85-1

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WH-4-023.cdx
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837422-57-8

>  <URL> (56)
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$$$$
Tasquinimod .cdx
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2796

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C20H17F3N2O4

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Tasquinimod

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HDAC

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254964-60-8

>  <URL> (57)
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G-749.cdx
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1457983-28-6

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685898-44-6

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717906-29-1

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

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>  <Mol_ID> (62)
2859

>  <Formula> (62)
C20H21F3N8O3S

>  <MolWeight> (62)
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>  <Cat> (62)
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>  <Name> (62)
Defactinib (VS-6063, PF-04554878)

>  <Synonyms> (62)
VS-6063, PF-04554878

>  <Target> (62)
FAK

>  <Form> (62)
Free Base

>  <CAS> (62)
1073154-85-4

>  <URL> (62)
http://www.selleckchem.com/products/defactinib.html

$$$$
RN486.cdx
csChFnd80/05071910422D

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>  <Mol_ID> (63)
2887

>  <Formula> (63)
C35H35FN6O3

>  <MolWeight> (63)
606.6892032

>  <Cat> (63)
S7080

>  <Name> (63)
RN486

>  <Synonyms> (63)
N/A

>  <Target> (63)
BTK

>  <Form> (63)
Free Base

>  <CAS> (63)
no

>  <URL> (63)
http://www.selleckchem.com/products/rn486.html

$$$$
Dovitinib Lactate.cdx
csChFnd80/05071910422D

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>  <Mol_ID> (64)
2888

>  <Formula> (64)
C24H27FN6O4

>  <MolWeight> (64)
482.5073832

>  <Cat> (64)
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>  <Name> (64)
Dovitinib (TKI258) Lactate

>  <Synonyms> (64)
N/A

>  <Target> (64)
FLT3

>  <Form> (64)
Lactate

>  <CAS> (64)
915769-50-5

>  <URL> (64)
http://www.selleckchem.com/products/dovitinib-tki258-lactate.html

$$$$
CH5183284 (Debio 1347).cdx
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>  <Mol_ID> (65)
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Monohydrate

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863127-77-9

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330161-87-0

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M  END
>  <Mol_ID> (74)
3080

>  <Formula> (74)
C28H24F3N7O2

>  <MolWeight> (74)
547.5310696

>  <Cat> (74)
S8140

>  <Name> (74)
GNF-7

>  <Synonyms> (74)
N/A

>  <Target> (74)
Bcr-Abl

>  <Form> (74)
Free Base

>  <CAS> (74)
839706-07-9

>  <URL> (74)
http://www.selleckchem.com/products/gnf-7.html

$$$$
Molidustat(BAY 85-3934).cdx
csChFnd80/05071910422D

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 12  8  1  0  0  0  0
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 23  7  1  0  0  0  0
M  END
>  <Mol_ID> (75)
3085

>  <Formula> (75)
C13H14N8O2

>  <MolWeight> (75)
314.30266

>  <Cat> (75)
S8138

>  <Name> (75)
Molidustat(BAY 85-3934)

>  <Synonyms> (75)
N/A

>  <Target> (75)
HIF

>  <Form> (75)
Free Base

>  <CAS> (75)
1154028-82-6

>  <URL> (75)
http://www.selleckchem.com/products/molidustat-(bay85-3934).html

$$$$
Daprodustat (GSK1278863).cdx
csChFnd80/05071910422D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (76)
3094

>  <Formula> (76)
C19H27N3O6

>  <MolWeight> (76)
393.43418

>  <Cat> (76)
S8171

>  <Name> (76)
Daprodustat (GSK1278863)

>  <Synonyms> (76)
N/A

>  <Target> (76)
HIF

>  <Form> (76)
Free Base

>  <CAS> (76)
960539-70-2

>  <URL> (76)
http://www.selleckchem.com/products/daprodustat.html

$$$$
Acalabrutinib.cdx
csChFnd80/05071910422D

 35 39  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (77)
3119

>  <Formula> (77)
C26H23N7O2

>  <MolWeight> (77)
465.50652

>  <Cat> (77)
S8116

>  <Name> (77)
Acalabrutinib (ACP-196)

>  <Synonyms> (77)
N/A

>  <Target> (77)
BTK

>  <Form> (77)
Free Base

>  <CAS> (77)
1420477-60-6

>  <URL> (77)
http://www.selleckchem.com/products/acalabrutinib.html

$$$$
BAY-61-3606.cdx
csChFnd80/05071910422D

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dihydrochloride

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648903-57-5

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http://www.selleckchem.com/products/bay-61-3606.html

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EGFR

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113104-25-9

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890128-81-1

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1446790-62-0

>  <URL> (81)
http://www.selleckchem.com/products/ro9021.html

$$$$
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>  <Target> (82)
FGFR

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1346242-81-6

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http://www.selleckchem.com/products/jnj-42756493-erdafitinib.html

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FGFR

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102586-30-1

>  <URL> (83)
http://www.selleckchem.com/products/nsc12.html

$$$$
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ASP8273 (Naquotinib)

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>  <Target> (84)
EGFR

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1448232-80-1

>  <URL> (84)
http://www.selleckchem.com/products/naquotinib-asp8273.html

$$$$
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ONO-4059 (GS-4059) hydrochloride

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BTK

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hydrochloride

>  <CAS> (85)
1439901-97-9

>  <URL> (85)
http://www.selleckchem.com/products/ono-4059-gs-4059.html

$$$$
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FGFR

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704869-38-5

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1187990-87-9
1187990-87-9

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1224887-10-8

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>  <Mol_ID> (94)
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>  <Formula> (94)
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N/A

>  <Target> (94)
Syk,FLT3,ZAP-70,JAK3,VEGFR2

>  <Form> (94)
hydrochloride 

>  <CAS> (94)
1952251-28-3

>  <URL> (94)
http://www.selleckchem.com/products/tak-659.html

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>  <Mol_ID> (95)
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>  <Formula> (95)
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>  <MolWeight> (95)
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>  <Cat> (95)
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>  <Name> (95)
LW 6

>  <Synonyms> (95)
N/A

>  <Target> (95)
HIF-1¦Á

>  <Form> (95)
free base

>  <CAS> (95)
934593-90-5

>  <URL> (95)
http://www.selleckchem.com/products/lw-6.html

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PRN1371.cdx
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>  <Mol_ID> (96)
3445

>  <Formula> (96)
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>  <Cat> (96)
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>  <Name> (96)
PRN1371

>  <Synonyms> (96)
N/A

>  <Target> (96)
FGFR1,FGFR2,FGFR3,CSF1R,FGFR4

>  <Form> (96)
free base

>  <CAS> (96)
1802929-43-6

>  <URL> (96)
http://www.selleckchem.com/products/prn1371.html

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BGB-3111.cdx
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>  <Mol_ID> (97)
3681

>  <Formula> (97)
C24H25N5O3

>  <MolWeight> (97)
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>  <Cat> (97)
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>  <Name> (97)
Btk inhibitor 2

>  <Synonyms> (97)
N/A

>  <Target> (97)
BTK

>  <Form> (97)
free base

>  <CAS> (97)
1558036-85-3

>  <URL> (97)
http://selleckchem.com/products/btk-inhibitor-2.html

$$$$
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    9.9687    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.9687    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1811    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3935    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3935    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1811    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6060    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8184    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8184    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6060    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1811    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3314   11.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  2  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13  9  1  0  0  0  0
 11 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
  6 18  1  0  0  0  0
 18 19  1  0  0  0  0
  3 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 20  1  0  0  0  0
 25 26  1  0  0  0  0
 24 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 32 27  1  0  0  0  0
 30 33  1  0  0  0  0
 33 34  2  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 31  1  0  0  0  0
 32 37  2  0  0  0  0
 18 38  2  0  0  0  0
M  END
>  <Mol_ID> (98)
3695

>  <Formula> (98)
C31H26N4O3

>  <MolWeight> (98)
502.56314

>  <Cat> (98)
S8348

>  <Name> (98)
BMS-935177

>  <Synonyms> (98)
N/A

>  <Target> (98)
BTK,Trk receptor,c-RET

>  <Form> (98)
free base

>  <CAS> (98)
1231889-53-4

>  <URL> (98)
http://selleckchem.com/products/bms-935177.html

$$$$
Asciminib(ABL001).cdx
csChFnd80/05071910422D

 31 34  0  0  0  0  0  0  0  0999 V2000
    3.4282    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4282    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6406    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8531    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8531    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6406    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2157    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2157    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0655    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0655    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2779    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.4904    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7028    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9152    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9152    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7028    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1277    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3401    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3401    2.1000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   15.5525    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   15.5525    1.4000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.0694    6.2923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    6.5834    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0000    5.3710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9368    4.3306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9368    2.6694    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.6290    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    0.4166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0694    0.7077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1306    7.8624    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  4  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
  7 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26  7  1  0  0  0  0
  8 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30  8  2  0  0  0  0
 24 31  1  1  0  0  0
M  END
>  <Mol_ID> (99)
3702

>  <Formula> (99)
C20H18ClF2N5O3

>  <MolWeight> (99)
449.8384264

>  <Cat> (99)
S8555

>  <Name> (99)
Asciminib (ABL001)

>  <Synonyms> (99)
N/A

>  <Target> (99)
Bcr-Abl

>  <Form> (99)
free base

>  <CAS> (99)
1492952-76-7

>  <URL> (99)
http://selleckchem.com/products/asciminib-abl001.html

$$$$
S5321 Y15.cdx
csChFnd80/05071910422D

 14 10  0  0  0  0  0  0  0  0999 V2000
    7.1296    0.7007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1296    2.0821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3200    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9158    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3200    2.7797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9158    2.7797    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.5338    0.7007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5338    2.0821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7510    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.7510    2.7797    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000   11.8001    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.7000   11.8001    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.4000   10.4001    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   10.4001    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  5  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7  8  2  0  0  0  0
  8 10  1  0  0  0  0
M  END
>  <Mol_ID> (100)
3769

>  <Formula> (100)
C6H14Cl4N4

>  <MolWeight> (100)
284.01416

>  <Cat> (100)
S5321

>  <Name> (100)
Y15

>  <Synonyms> (100)
1,2,4,5-Benzenetetraamine tetrahydrochloride

>  <Target> (100)
FAK

>  <Form> (100)
tetrahydrochloride 

>  <CAS> (100)
4506-66-5

>  <URL> (100)
http://selleckchem.com/products/y15.html

$$$$
S5205 Nilotinib  hydrochloride.cdx
csChFnd80/05071910422D

 40 43  0  0  0  0  0  0  0  0999 V2000
   12.1246    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9121    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6996    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873    0.6998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6996    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9121    0.6998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1246    4.1998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371    2.0998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748    2.7998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8500    2.7998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6375    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6375    0.6998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8500    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    0.6998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    4.1999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2126    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.7997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0002    4.1997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2126    4.8997    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5494    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7619    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9744    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9744    4.1998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7619    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5494    4.1998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7619    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5494    7.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   15.7619    7.6998    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   16.9744    7.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   18.3331    0.7076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7024    0.4164    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.4024    1.6289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4657    2.6693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1867    2.0998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.7948    1.7752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3135    4.2145    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4 10  1  0  0  0  0
  5  6  2  0  0  0  0
  5 39  1  0  0  0  0
  6  7  1  0  0  0  0
  9 23  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 16  2  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 18  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 17 18  1  0  0  0  0
 17 22  2  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 23 24  1  0  0  0  0
 23 28  2  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 25 37  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 29 32  1  0  0  0  0
 33 34  2  0  0  0  0
 33 37  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 35 38  1  0  0  0  0
 36 37  1  0  0  0  0
M  END
>  <Mol_ID> (101)
4049

>  <Formula> (101)
C28H23ClF3N7O

>  <MolWeight> (101)
565.9767296

>  <Cat> (101)
S5205

>  <Name> (101)
Nilotinib hydrochloride

>  <Synonyms> (101)
AMN-107 HCl

>  <Target> (101)
Bcr-Abl

>  <Form> (101)
hydrochloride 

>  <CAS> (101)
923288-95-3

>  <URL> (101)
http://selleckchem.com/products/nilotinib-hydrochloride.html

$$$$

csChFnd80/05071910422D

 57 60  0  0  0  0  0  0  0  0999 V2000
    8.8819   13.1669    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.4957   12.9710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1311   11.5207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3281   10.3739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2137   12.4084    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0826   11.0133    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3776    7.5550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7740    7.6559    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.0384    6.2722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8642    9.0530    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7467    5.8124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5921    8.7139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1958    8.6131    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2030    9.9736    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7929    2.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6655    4.0147    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.8780    3.3147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7384    5.0597    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3899    4.1790    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1730    2.7959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4206    2.1630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0754    0.6337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3238    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4967    0.7643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7932    1.5975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (102)
4115

>  <Formula> (102)
C35H49N11O9S2

>  <MolWeight> (102)
831.96186

>  <Cat> (102)
P1011

>  <Name> (102)
Eptifibatide Acetate

>  <Form> (102)
Acetate

>  <CAS> (102)
148031-34-9

$$$$

csChFnd80/05071910422D

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M  END
>  <Mol_ID> (103)
4121

>  <Formula> (103)
C59H84N16O12

>  <MolWeight> (103)
1209.39826

>  <Cat> (103)
P1013

>  <Name> (103)
Leuprorelin Acetate

>  <Target> (103)
5-alpha Reductase

>  <CAS> (103)
53714-56-0

>  <URL> (103)
http://selleckchem.com/products/leuprorelin-acetate.html

$$$$

csChFnd80/05071910422D

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M  END
>  <Mol_ID> (104)
4122

>  <Formula> (104)
C56H78N16O12

>  <MolWeight> (104)
1167.31852

>  <Cat> (104)
P1023

>  <Name> (104)
Alarelin Acetate

>  <CAS> (104)
79561-22-1

>  <URL> (104)
http://selleckchem.com/products/alarelin-acetate.html

$$$$

csChFnd80/05071910422D

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 87 89  2  0  0  0  0
M  END
>  <Mol_ID> (105)
4123

>  <Formula> (105)
C57H79N17O15

>  <MolWeight> (105)
1242.34206

>  <Cat> (105)
P1026

>  <Name> (105)
Gonadorelin Acetate

>  <Target> (105)
5-alpha Reductase

>  <CAS> (105)
71447-49-9

>  <URL> (105)
http://selleckchem.com/products/gonadorelin-acetate.html

$$$$

csChFnd80/05071910422D

 85 88  0  0  0  0  0  0  0  0999 V2000
   16.8873    7.2624    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   19.0382    6.5679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4185    7.6287    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   16.0388    9.4612    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3438    5.3817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   20.1472    9.3261    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (106)
4124

>  <Formula> (106)
C52H74N16O15S2

>  <MolWeight> (106)
1227.37216

>  <Cat> (106)
P1034

>  <Name> (106)
Terlipressin Acetate

>  <Target> (106)
5-alpha Reductase

>  <CAS> (106)
14636-12-5

>  <URL> (106)
http://selleckchem.com/products/terlipressin-acetate.html

$$$$

csChFnd80/05071910422D

247253  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (107)
4125

>  <Formula> (107)
C153H225N43O49S

>  <MolWeight> (107)
3482.7473

>  <Cat> (107)
P1056

>  <Name> (107)
Glucagon HCl

>  <Target> (107)
5-alpha Reductase

>  <CAS> (107)
16941-32-5

>  <URL> (107)
http://selleckchem.com/products/glucagon-hydrochloride.html

$$$$

csChFnd80/05071910422D

 35 39  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (108)
5288

>  <Formula> (108)
C25H26N6O2

>  <MolWeight> (108)
442.51294

>  <Cat> (108)
S8584

>  <Name> (108)
Theliatinib (HMPL-309)

>  <Synonyms> (108)
N/A

>  <Target> (108)
EGFR

>  <Form> (108)
free base

>  <CAS> (108)
1353644-70-8

>  <URL> (108)
http://www.selleck.cn/products/theliatinib-hmpl-309.html

$$$$

csChFnd80/05071910422D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 17 21  2  0  0  0  0
 17 22  2  0  0  0  0
M  END
>  <Mol_ID> (109)
5292

>  <Formula> (109)
C14H21N5O2S

>  <MolWeight> (109)
323.41384

>  <Cat> (109)
S8765

>  <Name> (109)
PF-04965842

>  <Synonyms> (109)
N/A

>  <Target> (109)
JAK

>  <Form> (109)
free base

>  <CAS> (109)
1622902-68-4

>  <URL> (109)
http://www.selleck.cn/products/pf-04965842.html

$$$$

csChFnd80/05071910422D

 35 38  0  0  0  0  0  0  0  0999 V2000
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   16.9741    7.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.1204    2.8077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4898    2.5166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   18.2531    4.7694    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.0593    1.2376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2364    0.1050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4516    1.0913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
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M  END
>  <Mol_ID> (110)
5294

>  <Formula> (110)
C24H26FN7O3

>  <MolWeight> (110)
479.5067432

>  <Cat> (110)
S8780

>  <Name> (110)
AZD3229

>  <Synonyms> (110)
N/A

>  <Target> (110)
c-Kit

>  <Form> (110)
free base

>  <CAS> (110)
2248003-60-1

>  <URL> (110)
http://www.selleck.cn/products/azd3229.html

$$$$
