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AG 013736

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VEGFR, PDGFR, c-Kit

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Saracatinib (AZD0530)

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N/A

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Src, Bcr-Abl

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Free Base

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http://www.selleckchem.com/products/AZD0530.html

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379231-04-6

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1

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untitled.cdx

$$$$
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csChFnd80/07131713162D

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4

>  <Formula> (3)
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>  <MolWeight> (3)
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>  <Item Name> (3)
AZD6244 (Selumetinib)

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S1008

>  <Synonyms> (3)
ARRY-142886

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MEK

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Free Base

>  <URL> (3)
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>  <CAS Number> (3)
606143-52-6

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M  END
>  <Mol_ID> (4)
5

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C31H33N5O4

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Nintedanib (BIBF 1120)

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N/A

>  <Target> (4)
VEGFR, PDGFR, FGFR

>  <Form> (4)
Free Base

>  <URL> (4)
http://www.selleckchem.com/products/BIBF1120.html

>  <CAS Number> (4)
656247-17-5

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untitled.cdx

$$$$
Bosutinib (SKI-606).cdx
csChFnd80/07131713162D

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>  <Mol_ID> (5)
6

>  <Formula> (5)
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>  <MolWeight> (5)
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>  <Item Name> (5)
Bosutinib (SKI-606)

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S1014

>  <Synonyms> (5)
N/A

>  <Target> (5)
Src

>  <Form> (5)
Free Base

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

>  <CAS Number> (5)
380843-75-4

>  <ALogP> (5)
4.883

>  <HBA_Count> (5)
4

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1

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9

>  <Name> (5)
Bosutinib (SKI-606).cdx

$$$$
untitled.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (6)
7

>  <Formula> (6)
C25H27FN4O3

>  <MolWeight> (6)
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>  <Item Name> (6)
Cediranib (AZD2171)

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>  <Synonyms> (6)
Recentin

>  <Target> (6)
VEGFR, Flt

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

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

>  <ALogP> (6)
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untitled.cdx

$$$$
CI1040.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (7)
8

>  <Formula> (7)
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N/A

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MEK

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Free Base

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

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CI1040.cdx

$$$$
Dasatinib.cdx
csChFnd80/07131713162D

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Sprycel

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Src, Bcr-Abl, c-Kit

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Free Base

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302962-49-8

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Dasatinib.cdx

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c-Kit, FGFR, Flt, VEGFR, PDGFR

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405169-16-6

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11

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ZD-1839

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EGFR

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Free Base

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

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184475-35-2

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untitled.cdx

$$$$
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Glivec, CGP-57148B, STI-571

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PDGFR, c-Kit, Bcr-Abl

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Imatinib Mesylate.cdx

$$$$
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Lapatinib (GW-572016) Ditosylate

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GW-57201

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EGFR, HER2

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Ditosylat

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http://www.selleckchem.com/products/Lapatinib-Ditosylate.html

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388082-77-7

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Lapatinib Ditosylate.cdx

$$$$
untitled.cdx
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Linifanib (ABT-869)

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AL-39324

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PDGFR, VEGFR

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Free Base

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$$$$
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VEGFR, PDGFR, c-Kit

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

$$$$
untitled.cdx
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15

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C28H22F3N7O

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Nilotinib (AMN-107)

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S1033

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Tasigna

>  <Target> (15)
Bcr-Abl

>  <Form> (15)
Free Base

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

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641571-10-0

>  <ALogP> (15)
5.084

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5

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2

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7

>  <Name> (15)
untitled.cdx

$$$$
untitled.cdx
csChFnd80/07131713162D

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16

>  <Formula> (16)
C21H24ClN7O2S

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473.97896

>  <Item Name> (16)
Pazopanib HCl

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S1035

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GW786034

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

>  <Form> (16)
Hydrochloride

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

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

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4.123

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5

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2

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5

>  <Name> (16)
untitled.cdx

$$$$
untitled.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (17)
17

>  <Formula> (17)
C16H14F3IN2O4

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PD0325901

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S1036

>  <Synonyms> (17)
N/A

>  <Target> (17)
MEK

>  <Form> (17)
Free Base

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

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

>  <ALogP> (17)
2.578

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2

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4

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7

>  <Name> (17)
untitled.cdx

$$$$
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csChFnd80/07131713162D

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>  <Mol_ID> (18)
18

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N/A

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DNA-PK, PI3K, mTOR

>  <Form> (18)
Free Base

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

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

>  <ALogP> (18)
2.798

>  <HBA_Count> (18)
5

>  <HBD_Count> (18)
1

>  <Num_RotatableBonds> (18)
2

>  <Name> (18)
1.cdx

$$$$
RAPAMYCIN.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (19)
19

>  <Formula> (19)
C51H79NO13

>  <MolWeight> (19)
914.17186

>  <Item Name> (19)
Rapamycin (Sirolimus)

>  <Catalog Number> (19)
S1039

>  <Synonyms> (19)
N/A

>  <Target> (19)
mTOR

>  <Form> (19)
Free Base

>  <URL> (19)
http://www.selleckchem.com/products/Rapamycin.html

>  <CAS Number> (19)
53123-88-9

>  <ALogP> (19)
6.295

>  <HBA_Count> (19)
10

>  <HBD_Count> (19)
2

>  <Num_RotatableBonds> (19)
6

>  <Name> (19)
RAPAMYCIN.cdx

$$$$

csChFnd80/07131713162D

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M  END
>  <Mol_ID> (20)
20

>  <Formula> (20)
C28H24ClF3N4O6S

>  <MolWeight> (20)
637.0265696

>  <Item Name> (20)
Sorafenib Tosylate

>  <Catalog Number> (20)
S1040

>  <Synonyms> (20)
Bay 43-9006

>  <Target> (20)
VEGFR, PDGFR, Raf

>  <Form> (20)
Tosylate

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

>  <CAS Number> (20)
475207-59-1

>  <ALogP> (20)
5.824

>  <HBA_Count> (20)
4

>  <HBD_Count> (20)
3

>  <Num_RotatableBonds> (20)
7

$$$$

csChFnd80/07131713162D

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M  END
>  <Mol_ID> (21)
21

>  <Formula> (21)
C26H33FN4O7

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532.5612232

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Sunitinib Malate (Sutent)

>  <Catalog Number> (21)
S1042

>  <Synonyms> (21)
SU-11248

>  <Target> (21)
VEGFR, PDGFR, c-Kit, Flt

>  <Form> (21)
Malate

>  <URL> (21)
http://www.selleckchem.com/products/Sunitinib-Malate-(Sutent).html

>  <CAS Number> (21)
341031-54-7

>  <ALogP> (21)
-1.049

>  <HBA_Count> (21)
4

>  <HBD_Count> (21)
4

>  <Num_RotatableBonds> (21)
10

$$$$
untitled.cdx
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M  END
>  <Mol_ID> (22)
22

>  <Formula> (22)
C23H28N8OS

>  <MolWeight> (22)
464.58642

>  <Item Name> (22)
VX-680 (MK-0457, Tozasertib)

>  <Catalog Number> (22)
S1048

>  <Synonyms> (22)
N/A

>  <Target> (22)
Aurora Kinase

>  <Form> (22)
Free Base

>  <URL> (22)
http://www.selleckchem.com/products/VX-680(MK-0457).html

>  <CAS Number> (22)
639089-54-6

>  <ALogP> (22)
4.445

>  <HBA_Count> (22)
4

>  <HBD_Count> (22)
3

>  <Num_RotatableBonds> (22)
7

>  <Name> (22)
untitled.cdx

$$$$
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csChFnd80/07131713162D

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M  END
>  <Mol_ID> (23)
23

>  <Formula> (23)
C14H23Cl2N3O

>  <MolWeight> (23)
320.25792

>  <Item Name> (23)
Y-27632 2HCl

>  <Catalog Number> (23)
S1049

>  <Synonyms> (23)
N/A

>  <Target> (23)
ROCK

>  <Form> (23)
Dihydrochloride

>  <URL> (23)
http://www.selleckchem.com/products/Y-27632.html

>  <CAS Number> (23)
129830-38-2

>  <ALogP> (23)
1.871

>  <HBA_Count> (23)
2

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2

>  <Num_RotatableBonds> (23)
3

>  <Name> (23)
Y-27632 2HCL.cdx

$$$$
untitled.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (24)
24

>  <Formula> (24)
C32H29N5O2

>  <MolWeight> (24)
515.60496

>  <Item Name> (24)
Enzastaurin (LY317615)

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S1055

>  <Synonyms> (24)
N/A

>  <Target> (24)
PKC

>  <Form> (24)
Free Base

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

>  <CAS Number> (24)
170364-57-5

>  <ALogP> (24)
4.32

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3

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1

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5

>  <Name> (24)
untitled.cdx

$$$$
untitled.cdx
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PI3K

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957054-30-7

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untitled.cdx

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p38 MAPK

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>  <HBA_Count> (32)
4

>  <HBD_Count> (32)
2

>  <Num_RotatableBonds> (32)
5

>  <Name> (32)
untitled.cdx

$$$$
Brivanib.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (33)
33

>  <Formula> (33)
C19H19FN4O3

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370.3775632

>  <Item Name> (33)
Brivanib (BMS-540215)

>  <Catalog Number> (33)
S1084

>  <Synonyms> (33)
N/A

>  <Target> (33)
VEGFR, FGFR

>  <Form> (33)
Free Base

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

>  <CAS Number> (33)
649735-46-6

>  <ALogP> (33)
3.481

>  <HBA_Count> (33)
4

>  <HBD_Count> (33)
2

>  <Num_RotatableBonds> (33)
5

>  <Name> (33)
Brivanib.cdx

$$$$
untitled.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (34)
34

>  <Formula> (34)
C21H17NO3S2

>  <MolWeight> (34)
395.49458

>  <Item Name> (34)
KU-55933 (ATM Kinase Inhibitor)

>  <Catalog Number> (34)
S1092

>  <Synonyms> (34)
N/A

>  <Target> (34)
ATM

>  <Form> (34)
Free Base

>  <URL> (34)
http://www.selleckchem.com/products/KU-55933.html

>  <CAS Number> (34)
587871-26-9

>  <ALogP> (34)
4.393

>  <HBA_Count> (34)
3

>  <HBD_Count> (34)
0

>  <Num_RotatableBonds> (34)
2

>  <Name> (34)
untitled.cdx

$$$$
untitled.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (35)
35

>  <Formula> (35)
C44H47F2N9O5S

>  <MolWeight> (35)
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>  <Item Name> (35)
GSK1904529A

>  <Catalog Number> (35)
S1093

>  <Synonyms> (35)
N/A

>  <Target> (35)
IGF-1R

>  <Form> (35)
Free Base

>  <URL> (35)
http://www.selleckchem.com/products/GSK1904529A.html

>  <CAS Number> (35)
1089283-49-7

>  <ALogP> (35)
6.571

>  <HBA_Count> (35)
8

>  <HBD_Count> (35)
2

>  <Num_RotatableBonds> (35)
12

>  <Name> (35)
untitled.cdx

$$$$
untitled.cdx
csChFnd80/07131713162D

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Aurora Kinase, FGFR, Bcr-Abl, c-RET, Src

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PLK

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Free Base

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755038-02-9

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c-Met, VEGFR

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c-Met

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untitled.cdx

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csChFnd80/07131713162D

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>  <Mol_ID> (48)
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Certican, Zortress, Afinitor

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mTOR

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Everolimus.cdx

$$$$
mln8237.cdx
csChFnd80/07131713162D

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Cabozantinib (XL184, BMS-907351)

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BMS-907351

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VEGFR, c-Met, Flt, Tie-2, c-Kit

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Free Base

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http://www.selleckchem.com/products/XL184.html

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849217-68-1

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N/A

>  <Target> (51)
Bcr-Abl, JAK, Aurora Kinase

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Free Base

>  <URL> (51)
http://www.selleckchem.com/products/AT9283.html

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896466-04-9

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1.51

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AT9283.cdx

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52

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C22H24FN5O4

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>  <Item Name> (52)
Brivanib alaninate (BMS-582664)

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S1138

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N/A

>  <Target> (52)
VEGFR, FGFR

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Alaninate

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

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649735-63-7

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3.383

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6

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JAK, EGFR

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AG-490.cdx

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55

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Barasertib (AZD1152-HQPA)

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S1147

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AZD1152

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Aurora Kinase

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Free Base

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http://www.selleckchem.com/products/AZD1152-HQPA.html

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722544-51-6

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>  <Mol_ID> (56)
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S1152

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N/A

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Raf

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http://www.selleckchem.com/products/PLX-4720.html

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918505-84-7

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CDK

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186692-46-6

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csChFnd80/07131713162D

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Aurora Kinase

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EGFR, HER2

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EGFR

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Free Base

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1214265-57-2

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N/A

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Flt, Aurora Kinase, VEGFR

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Tartaric Acid

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

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934353-76-1

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2

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ENMD-2076.cdx

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S119401 CUDC-101.cdx
csChFnd80/07131713162D

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HDAC, EGFR, HER2

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S119401 CUDC-101.cdx

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VEGFR, c-Kit, PDGFR

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OSI-930.cdx
csChFnd80/07131713162D

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EGFR

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   10.8909    6.9927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8909    8.3879    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   13.3115    4.1951    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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  5  6  2  0  0  0  0
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  4  7  1  0  0  0  0
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  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
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  9 12  1  0  0  0  0
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 32 27  1  0  0  0  0
 32 33  1  0  0  0  0
 30 34  1  0  0  0  0
M  END
>  <Mol_ID> (81)
81

>  <Formula> (81)
C24H18F3N3O4

>  <MolWeight> (81)
469.4126296

>  <Item Name> (81)
Ki8751

>  <Catalog Number> (81)
S1363

>  <Synonyms> (81)
N/A

>  <Target> (81)
VEGFR, c-Kit, PDGFR

>  <Form> (81)
Free Base

>  <URL> (81)
http://www.selleckchem.com/products/Ki8751.html

>  <CAS Number> (81)
228559-41-9

>  <ALogP> (81)
4.853

>  <HBA_Count> (81)
5

>  <HBD_Count> (81)
2

>  <Num_RotatableBonds> (81)
6

>  <Name> (81)
KI8751.cdx

$$$$
CHIR-99021 (CT99021) hcl.cdx
csChFnd80/07131713162D

 33 35  0  0  0  0  0  0  0  0999 V2000
   10.8798    4.9415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8798    3.5415    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.0922    2.8415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3047    3.5415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3047    4.9415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0922    5.6415    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5129    5.6391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5129    2.8440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6716    5.6391    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4633    4.9415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2551    5.6391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0469    4.9415    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8387    5.6391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8387    7.0391    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6262    7.7391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4138    7.0391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4138    5.6391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6262    4.9391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2056    7.7367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.4318    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.6592    1.4516    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.0286    1.1606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7919    3.4134    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7253    4.9391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9378    5.6391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7253    7.7391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5129    7.0391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1161    2.5188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1460    7.7367    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   13.3047    7.7367    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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  1  9  1  0  0  0  0
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 18 13  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  3  0  0  0  0
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 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24  8  2  0  0  0  0
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 25 26  1  0  0  0  0
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 29  7  1  0  0  0  0
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 27 31  1  0  0  0  0
 29 32  1  0  0  0  0
M  END
>  <Mol_ID> (82)
82

>  <Formula> (82)
C22H19Cl3N8

>  <MolWeight> (82)
501.79886

>  <Item Name> (82)
CHIR-99021 (CT99021) HCl

>  <Catalog Number> (82)
S2924

>  <Synonyms> (82)
N/A

>  <Target> (82)
PI3K/Akt/mTOR

>  <Form> (82)
Hydrochloride

>  <URL> (82)
http://www.selleckchem.com/products/chir-99021-ct99021-hcl.html

>  <CAS Number> (82)
252917-06-9 (free base)

>  <ALogP> (82)
4.858

>  <HBA_Count> (82)
4

>  <HBD_Count> (82)
3

>  <Num_RotatableBonds> (82)
7

>  <Name> (82)
CHIR-99021 (CT99021) hcl.cdx

$$$$
Pelitinib.cdx
csChFnd80/07131713162D

 33 35  0  0  0  0  0  0  0  0999 V2000
    8.4576    7.6879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4576    6.2879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6700    5.5879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8825    6.2879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8825    7.6879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.0949    5.5879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3073    6.2879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3073    7.6879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0949    8.3879    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5156    5.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7280    4.8903    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2494    8.3854    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3031    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5156    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7280    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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 10  5  1  0  0  0  0
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 11 12  3  0  0  0  0
M  END
>  <Mol_ID> (83)
83

>  <Formula> (83)
C24H23ClFN5O2

>  <MolWeight> (83)
467.9231232

>  <Item Name> (83)
Pelitinib (EKB-569)

>  <Catalog Number> (83)
S1392

>  <Synonyms> (83)
WAY-EKB 569

>  <Target> (83)
EGFR

>  <Form> (83)
Free Base

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

>  <CAS Number> (83)
257933-82-7

>  <ALogP> (83)
4.455

>  <HBA_Count> (83)
3

>  <HBD_Count> (83)
2

>  <Num_RotatableBonds> (83)
8

>  <Name> (83)
Pelitinib.cdx

$$$$
Aurora A Inhibitor I.cdx
csChFnd80/07131713162D

 42 46  0  0  0  0  0  0  0  0999 V2000
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   16.9404    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1529    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1529    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7280    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3611    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.3611    5.5879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (84)
84

>  <Formula> (84)
C31H31ClFN7O2

>  <MolWeight> (84)
588.0749432

>  <Item Name> (84)
Aurora A Inhibitor I

>  <Catalog Number> (84)
S1451

>  <Synonyms> (84)
N/A

>  <Target> (84)
Aurora Kinase

>  <Form> (84)
Free Base

>  <URL> (84)
http://www.selleckchem.com/products/Aurora-A-Inhibitor-I.html

>  <CAS Number> (84)
1158838-45-9

>  <ALogP> (84)
5.621

>  <HBA_Count> (84)
4

>  <HBD_Count> (84)
3

>  <Num_RotatableBonds> (84)
9

>  <Name> (84)
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ROCK

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csChFnd80/07131713162D

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CDK

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   10.8783    7.3597    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.0865    8.0573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0865    9.4524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2989   10.1524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2989   11.5525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0865   12.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8741   11.5525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8741   10.1524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9672    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  5  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  6  1  0  0  0  0
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
  3 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  1 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 23  1  0  0  0  0
M  END
>  <Mol_ID> (112)
112

>  <Formula> (112)
C22H33ClN6

>  <MolWeight> (112)
416.99062

>  <Item Name> (112)
BS-181 HCl

>  <Catalog Number> (112)
S1572

>  <Synonyms> (112)
N/A

>  <Target> (112)
CDK

>  <Form> (112)
Hydrochloride

>  <URL> (112)
http://www.selleckchem.com/products/BS-181.html

>  <CAS Number> (112)
1397219-81-6

>  <ALogP> (112)
4.684

>  <HBA_Count> (112)
2

>  <HBD_Count> (112)
3

>  <Num_RotatableBonds> (112)
11

>  <Name> (112)
BS-181.cdx

$$$$
Fasudil HCl.cdx
csChFnd80/07131713162D

 21 22  0  0  0  0  0  0  0  0999 V2000
    1.2124    6.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.6083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.6083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.7083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.5083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.8083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.5083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    3.9108    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    3.2108    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5431    5.1190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1480    2.7025    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0577    1.8108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1522    0.9377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5171    1.2490    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1248    2.5103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5171    3.7717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1522    4.0835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1388    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  3  1  0  0  0  0
  4 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 11 14  2  0  0  0  0
 12 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 12  1  0  0  0  0
M  END
>  <Mol_ID> (113)
113

>  <Formula> (113)
C14H18ClN3O2S

>  <MolWeight> (113)
327.82962

>  <Item Name> (113)
Fasudil HCl (HA-1077)

>  <Catalog Number> (113)
S1573

>  <Synonyms> (113)
AT-877

>  <Target> (113)
ROCK

>  <Form> (113)
Hydrochloride

>  <URL> (113)
http://www.selleckchem.com/products/Fasudil-HCl(HA-1077).html

>  <CAS Number> (113)
105628-07-7

>  <ALogP> (113)
0.57

>  <HBA_Count> (113)
3

>  <HBD_Count> (113)
1

>  <Num_RotatableBonds> (113)
2

>  <Name> (113)
Fasudil HCl.cdx

$$$$
BIRB 796 (Doramapimod).cdx
csChFnd80/07131713162D

 39 43  0  0  0  0  0  0  0  0999 V2000
    8.3036    7.4376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3036    6.0376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5160    5.3376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7285    6.0376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7285    7.4376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5160    8.1376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5160    3.9376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7285    3.2376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9409    3.9376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9409    5.3376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9367    8.1351    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1449    7.4376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3532    8.1351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5614    7.4376    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0954    5.3400    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8872    6.0376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6789    5.3400    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4707    6.0376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8872    7.4327    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1917    5.4681    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3875    8.9955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2075   10.1242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    9.1413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0252   10.3478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9017    4.1035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5702    3.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2791    2.3014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3195    1.3647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6510    1.7973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9421    3.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5614    6.0376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7738    5.3376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9863    6.0376    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.9863    7.4376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7738    8.1376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  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  4  1  0  0  0  0
  5 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
  2 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
 16 19  2  0  0  0  0
 18 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 18  1  0  0  0  0
 21 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 24 27  1  0  0  0  0
 23 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 28  1  0  0  0  0
 14 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 14  1  0  0  0  0
 31 39  1  0  0  0  0
M  END
>  <Mol_ID> (114)
114

>  <Formula> (114)
C31H37N5O3

>  <MolWeight> (114)
527.65718

>  <Item Name> (114)
BIRB 796 (Doramapimod)

>  <Catalog Number> (114)
S1574

>  <Synonyms> (114)
N/A

>  <Target> (114)
p38 MAPK

>  <Form> (114)
Free Base

>  <URL> (114)
http://www.selleckchem.com/products/BIRB-796-(Doramapimod).html

>  <CAS Number> (114)
285983-48-4

>  <ALogP> (114)
5.907

>  <HBA_Count> (114)
4

>  <HBD_Count> (114)
2

>  <Num_RotatableBonds> (114)
8

>  <Name> (114)
BIRB 796 (Doramapimod).cdx

$$$$
Tie 2k inase inhibitor.cdx
csChFnd80/07131713162D

 32 36  0  0  0  0  0  0  0  0999 V2000
    4.8455    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6330    3.4976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8101    4.6302    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.0282    3.4976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3499    5.0176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3499    6.4176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1375    7.1176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9251    6.4176    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9251    5.0176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1375    4.3176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7282    2.2851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1282    2.2851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8282    3.4976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1282    4.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7282    4.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2233    3.4976    0.0000 S   0  0  3  0  0  0  0  0  0  0  0  0
   16.9209    2.2893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9209    4.7058    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
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  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  2  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
  5 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
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 17 14  1  0  0  0  0
 16 18  1  0  0  0  0
 14 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
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 18 25  2  0  0  0  0
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 29 18  1  0  0  0  0
 27 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  2  0  0  0  0
M  END
>  <Mol_ID> (115)
115

>  <Formula> (115)
C26H21N3O2S

>  <MolWeight> (115)
439.52884

>  <Item Name> (115)
Tie2 kinase inhibitor

>  <Catalog Number> (115)
S1577

>  <Synonyms> (115)
N/A

>  <Target> (115)
Tie-2

>  <Form> (115)
Free Base

>  <URL> (115)
http://www.selleckchem.com/products/Tie2-kinase-inhibitor.html

>  <CAS Number> (115)
948557-43-5

>  <ALogP> (115)
4.57

>  <HBA_Count> (115)
4

>  <HBD_Count> (115)
1

>  <Num_RotatableBonds> (115)
5

>  <Name> (115)
Tie 2k inase inhibitor.cdx

$$$$

csChFnd80/07131713162D

 38 41  0  0  0  0  0  0  0  0999 V2000
    5.2249  -11.8902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2249  -13.2902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4373  -13.9902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.0745  -13.2902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0745  -11.8902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8622  -11.1902    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4373   -9.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6498   -9.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6498   -7.6951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (116)
116

>  <Formula> (116)
C27H30Cl2F2N6O

>  <MolWeight> (116)
563.4695064

>  <Item Name> (116)
NVP-BSK805 2HCl

>  <Catalog Number> (116)
S2686

>  <Synonyms> (116)
N/A

>  <Target> (116)
JAK

>  <Form> (116)
HCl

>  <URL> (116)
http://www.selleckchem.com/products/nvp-bsk805.html

>  <CAS Number> (116)
1092499-93-8 (free base)

>  <ALogP> (116)
3.92

>  <HBA_Count> (116)
4

>  <HBD_Count> (116)
1

>  <Num_RotatableBonds> (116)
5

$$$$
DCC-2036.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (117)
117

>  <Formula> (117)
C30H28FN7O3

>  <MolWeight> (117)
553.5868232

>  <Item Name> (117)
DCC-2036 (Rebastinib)

>  <Catalog Number> (117)
S2634

>  <Synonyms> (117)
N/A

>  <Target> (117)
Bcr-Abl

>  <Form> (117)
Free Base

>  <URL> (117)
http://www.selleckchem.com/products/dcc-2036.html

>  <CAS Number> (117)
1020172-07-9

>  <ALogP> (117)
5.14

>  <HBA_Count> (117)
6

>  <HBD_Count> (117)
3

>  <Num_RotatableBonds> (117)
7

>  <Name> (117)
DCC-2036.cdx

$$$$
Indirubin.cdx
csChFnd80/07131713162D

 20 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (118)
118

>  <Formula> (118)
C16H10N2O2

>  <MolWeight> (118)
262.2628

>  <Item Name> (118)
Indirubin

>  <Catalog Number> (118)
S2386

>  <Synonyms> (118)
N/A

>  <Target> (118)
GSK-3

>  <Form> (118)
Free Base

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

>  <CAS Number> (118)
479-41-4

>  <ALogP> (118)
1.876

>  <HBA_Count> (118)
2

>  <HBD_Count> (118)
2

>  <Num_RotatableBonds> (118)
0

>  <Name> (118)
Indirubin.cdx

$$$$
Quercetin.cdx
csChFnd80/07131713162D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (119)
119

>  <Formula> (119)
C15H10O7

>  <MolWeight> (119)
302.2357

>  <Item Name> (119)
Quercetin (Sophoretin)

>  <Catalog Number> (119)
S2391

>  <Synonyms> (119)
Meletin, Quercetine

>  <Target> (119)
PI3K, PKC, Src, Sirtuin

>  <Form> (119)
Free Base

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

>  <CAS Number> (119)
117-39-5

>  <ALogP> (119)
1.63

>  <HBA_Count> (119)
2

>  <HBD_Count> (119)
5

>  <Num_RotatableBonds> (119)
1

>  <Name> (119)
Quercetin.cdx

$$$$
E7080.cdx
csChFnd80/07131713162D

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JAK

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AZD8931.cdx

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PLK

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CP-473420

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EGFR

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Hydrochloride

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132

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C22H19N7O

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>  <Target> (132)
PI3K

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Free Base

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900185-01-5

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PIK 293.cdx

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S2214

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JAK

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905586-69-8

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AZ 960.cdx

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Mubritinib.cdx
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HER2

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366017-09-6

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Mubritinib.cdx

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PP442.cdx
csChFnd80/07131713162D

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TORKinib

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mTOR

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136

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C23H22N6O2

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Momelotinib (CYT387)

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S2219

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CYT 11387

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JAK

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Free Base

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1056634-68-4

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CYT 387.cdx

$$$$
SB 590885.cdx
csChFnd80/07131713162D

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Raf

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SB 590885.cdx

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Asiatic acid.cdx
csChFnd80/07131713162D

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p38 MAPK

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Honokiol.cdx
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>  <Mol_ID> (139)
139

>  <Formula> (139)
C18H18O2

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266.33432

>  <Item Name> (139)
Honokiol

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S2310

>  <Synonyms> (139)
N/A

>  <Target> (139)
Akt, MEK

>  <Form> (139)
Free Base

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

>  <CAS Number> (139)
35354-74-6

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4.88

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0

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2

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Honokiol.cdx

$$$$
Chrysophanic acid.cdx
csChFnd80/07131713162D

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140

>  <Formula> (140)
C15H10O4

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254.2375

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Chrysophanic acid (Chrysophanol)

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S2406

>  <Synonyms> (140)
Chrysophanol, NSC 37132, NSC 646567

>  <Target> (140)
EGFR, mTOR

>  <Form> (140)
Free Base

>  <URL> (140)
http://www.selleckchem.com/products/Chrysophanic-acid-Chrysophanol.html

>  <CAS Number> (140)
481-74-3

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2.81

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2

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2

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0

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Chrysophanic acid.cdx

$$$$
PCI-32765.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (141)
141

>  <Formula> (141)
C25H24N6O2

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440.49706

>  <Item Name> (141)
PCI-32765 (Ibrutinib)

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S2680

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N/A

>  <Target> (141)
Src

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Free Base

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936563-96-1

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1

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5

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PCI-32765.cdx

$$$$
TAK-901.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (142)
142

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C28H32N4O3S

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TAK-901

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S2718

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N/A

>  <Target> (142)
Aurora Kinase

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Free Base

>  <URL> (142)
http://www.selleckchem.com/products/tak-901.html

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934541-31-8

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>  <Name> (142)
TAK-901.cdx

$$$$
TG1012009.cdx
csChFnd80/07131713162D

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Aurora Kinase

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p38 MAPK

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JAK

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CP-690550 citrate.cdx

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mTOR

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N/A

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mTOR, PI3K

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GDC 0980.cdx

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>  <Formula> (186)
C21H21Cl2NO5

>  <MolWeight> (186)
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>  <Item Name> (186)
Flavopiridol (Alvocidib) HCl

>  <Catalog Number> (186)
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>  <Synonyms> (186)
N/A

>  <Target> (186)
CDK

>  <Form> (186)
Hydrochloride

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

>  <CAS Number> (186)
131740-09-5

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Flavopiridol hydrochloride.cdx

$$$$
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>  <Formula> (187)
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>  <Item Name> (187)
PH-797804

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>  <Synonyms> (187)
N/A

>  <Target> (187)
p38 MAPK

>  <Form> (187)
Free Base

>  <URL> (187)
http://www.selleckchem.com/products/ph-797804.html

>  <CAS Number> (187)
586379-66-0

>  <ALogP> (187)
3.801

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>  <Name> (187)
PH797804.cdx

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PF299804.cdx
csChFnd80/07131713162D

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188

>  <Formula> (188)
C24H25ClFN5O2

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>  <Item Name> (188)
Dacomitinib (PF299804, PF-00299804)

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S2727

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N/A

>  <Target> (188)
EGFR

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Free Base

>  <URL> (188)
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1110813-31-4

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5.055

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>  <Name> (188)
PF299804.cdx

$$$$
SB415286.cdx
csChFnd80/07131713162D

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Raf

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AZ628.cdx

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EGFR, HER2

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201

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NVP-BGT226

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S2749

>  <Synonyms> (201)
N/A

>  <Target> (201)
PI3K, mTOR

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Maleate

>  <URL> (201)
http://www.selleckchem.com/products/nvp-bgt226.html

>  <CAS Number> (201)
1245537-68-1

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1.618

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NVP-BGT226.cdx

$$$$
YM201636.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (202)
202

>  <Formula> (202)
C25H21N7O3

>  <MolWeight> (202)
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S1219

>  <Synonyms> (202)
N/A

>  <Target> (202)
PI3K

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Free Base

>  <URL> (202)
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>  <CAS Number> (202)
371942-69-7

>  <ALogP> (202)
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7

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2

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4

>  <Name> (202)
YM201636.cdx

$$$$
AG1024.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (203)
203

>  <Formula> (203)
C14H13BrN2O

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N/A

>  <Target> (203)
IGF-1R

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Free Base

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65678-07-1

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AG1024.cdx

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3-Methyladenine.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (204)
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>  <Formula> (204)
C6H7N5

>  <MolWeight> (204)
149.15328

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S2767

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3-MA

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PI3K

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5142-23-4

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1

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3-Methyladenine.cdx

$$$$
ARQ-197.cdx
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c-Met

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ARQ-197.cdx

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PDK-1, IKK

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702675-74-9

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BX-795.cdx

$$$$
BX-912.cdx
csChFnd80/07131713162D

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BX-912.cdx

$$$$
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c-Met

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1185763-69-2

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NVP-BVU972.cdx

$$$$
CUDC-907.cdx
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M  END
>  <Mol_ID> (209)
209

>  <Formula> (209)
C23H24N8O4S

>  <MolWeight> (209)
508.55286

>  <Item Name> (209)
CUDC-907

>  <Catalog Number> (209)
S2759

>  <Synonyms> (209)
N/A

>  <Target> (209)
HDAC, PI3K

>  <Form> (209)
Free Base

>  <URL> (209)
http://www.selleckchem.com/products/cudc-907.html

>  <CAS Number> (209)
1339928-25-4

>  <ALogP> (209)
2.303

>  <HBA_Count> (209)
8

>  <HBD_Count> (209)
1

>  <Num_RotatableBonds> (209)
7

>  <Name> (209)
CUDC-907.cdx

$$$$

csChFnd80/07131713162D

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M  END
>  <Mol_ID> (210)
210

>  <Formula> (210)
C27H33FN6O7

>  <MolWeight> (210)
572.5853232

>  <Item Name> (210)
Dovitinib Dilactic acid (TKI258 Dilactic aci

>  <Catalog Number> (210)
S2769

>  <Synonyms> (210)
CHIR-258 Dilactic acid

>  <Target> (210)
Flt, FGFR, PDGFR, VEGFR, c-Kit

>  <Form> (210)
Dilactic Acid

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

>  <CAS Number> (210)
852433-84-2

>  <ALogP> (210)
-2.038

>  <HBA_Count> (210)
4

>  <HBD_Count> (210)
5

>  <Num_RotatableBonds> (210)
4

$$$$
AST-1306.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (211)
211

>  <Formula> (211)
C31H26ClFN4O5S

>  <MolWeight> (211)
621.0783432

>  <Item Name> (211)
AST-1306

>  <Catalog Number> (211)
S2185

>  <Synonyms> (211)
N/A

>  <Target> (211)
EGFR

>  <Form> (211)
Mesylate

>  <URL> (211)
http://www.selleckchem.com/products/ast-1306.html

>  <CAS Number> (211)
1050500-29-2

>  <ALogP> (211)
7.381

>  <HBA_Count> (211)
4

>  <HBD_Count> (211)
2

>  <Num_RotatableBonds> (211)
8

>  <Name> (211)
AST-1306.cdx

$$$$
BMS265246.cdx
csChFnd80/07131713162D

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S6 Kinase

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501437-28-1

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EGFR

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Free Base

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Tyrphostin AG 17.cdx

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N/A

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VEGFR

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193000-39-4

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ZM323881 HCl.cdx

$$$$
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csChFnd80/07131713162D

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244

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VEGFR

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Free Base

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ZM306416.cdx

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JAK

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S-Ruxolitinib.cdx

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csChFnd80/07131713162D

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341.79154

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S8003

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N/A

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IGF-1R

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Free Base

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196868-63-0

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3.639

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3

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>  <Mol_ID> (260)
260

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C10H6N2O2

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186.16684

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AG 18 (Tyrphostin 23)

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S8009

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RG-50810

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EGFR

>  <Form> (260)
Free Base

>  <URL> (260)
http://www.selleckchem.com/products/ag-18-tyrphostin-23.html

>  <CAS Number> (260)
118409-57-7

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1.531

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0

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2

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1

>  <Name> (260)
AG 18.cdx

$$$$
OSI-906.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (261)
261

>  <Formula> (261)
C26H23N5O

>  <MolWeight> (261)
421.49372

>  <Item Name> (261)
OSI-906 (Linsitinib)

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S1091

>  <Synonyms> (261)
N/A

>  <Target> (261)
IGF-1R

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Free Base

>  <URL> (261)
http://www.selleckchem.com/products/OSI-906.html

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867160-71-2

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3.757

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3

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OSI-906.cdx

$$$$
aicar.cdx
csChFnd80/07131713162D

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262

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C9H14N4O5

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258.23126

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AICAR (Acadesine)

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S1802

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AICAR, AICA-riboside

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AMPK

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Free Base

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2627-69-2

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5

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3

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aicar.cdx

$$$$

csChFnd80/07131713162D

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FLT3

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301305-73-7

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flt-3 inhibitor I(TCS 359).cdx

$$$$
Cabozantinib£¨XL-184) malate.cdx
csChFnd80/07131713162D

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269

>  <Formula> (269)
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S4001

>  <Synonyms> (269)
N/A

>  <Target> (269)
VEGFR

>  <Form> (269)
Malate

>  <URL> (269)
http://www.selleckchem.com/products/cabozantinib-malate.html

>  <CAS Number> (269)
1140909-48-3

>  <ALogP> (269)
3.331

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Cabozantinib£¨XL-184) malate.cdx

$$$$
PF-04708671.cdx
csChFnd80/07131713162D

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PF-04708671

>  <Target> (270)
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>  <URL> (270)
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>  <Name> (270)
PF-04708671.cdx

$$$$
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Syk

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c-Myc

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10058-F4.cdx

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CDK

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HCl

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p38 MAPK

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JAK

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935666-88-9, 1260222-79-4 (TFA)

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MEK162 (ARRY-438162).cdx
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MEK

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606143-89-9

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Akt

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M  END
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301

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C16H10BrN3O2

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BIO

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S7198

>  <Synonyms> (301)
GSK-3 Inhibitor IX, 6-bromoindirubin-3-oxime

>  <Target> (301)
GSK-3

>  <Form> (301)
Free Base

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

>  <CAS Number> (301)
667463-62-9

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2.692

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2

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2

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0

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BIO (6-bromoindirubin-3-oxime).cdx

$$$$
AZD2858.cdx
csChFnd80/07131713162D

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302

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C21H23N7O3S

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AZD2858

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S7253

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N/A

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GSK-3

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Free Base

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486424-20-8

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6

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AZD2858.cdx

$$$$
ZM39923 HCl.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (303)
303

>  <Formula> (303)
C23H26ClNO

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ZM 39923 HCl

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S8004

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N/A

>  <Target> (303)
JAK

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HCl

>  <URL> (303)
http://www.selleckchem.com/products/zm-39923-hcl.html

>  <CAS Number> (303)
1021868-92-7

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5.424

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1

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0

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>  <Name> (303)
ZM39923 HCl.cdx

$$$$
CZC24832.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (304)
304

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>  <Item Name> (304)
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N/A

>  <Target> (304)
Product Categories
PI3K/Akt/mTORPI3K
PI3K

>  <Form> (304)
Free Base

>  <URL> (304)
http://www.selleckchem.com/products/czc24832.html

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4

>  <Name> (304)
CZC24832.cdx

$$$$
ETP-46464.cdx
csChFnd80/07131713162D

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Others

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Free Base

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1374828-69-9

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GNE-0877.cdx

$$$$
PF-543 .cdx
csChFnd80/07131713162D

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330

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N/A

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S1P Receptor

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Free Base

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1415562-82-1

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5.016

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PF-543 .cdx

$$$$
AZD1208.cdx
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Pim

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1204144-28-4

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AZD1208.cdx

$$$$
CX-6258 HCl .cdx
csChFnd80/07131713162D

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332

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Pim

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>  <URL> (332)
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CX-6258 HCl .cdx

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Bcr-Abl

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Free Base

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http://www.selleckchem.com/products/pd173955.html

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260415-63-2

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PD173955 .cdx

$$$$
Zotarolimus.cdx
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N/A

>  <Target> (341)
mTOR

>  <Form> (341)
Free Base

>  <URL> (341)
http://www.selleckchem.com/products/zotarolimus-abt-578.html

>  <CAS Number> (341)
221877-54-9

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13

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1

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>  <Name> (341)
Zotarolimus.cdx

$$$$
WH-4-023.cdx
csChFnd80/07131713162D

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Src

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WH-4-023.cdx

$$$$
IM-12.cdx
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GSK-3

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1129669-05-1

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IM-12.cdx

$$$$
BIBW2992 (Afatinib).cdx
csChFnd80/07131713162D

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EGFR

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BIBW2992 (Afatinib).cdx

$$$$
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JAK

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941678-49-5

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R-Ruxolitinib.cdx

$$$$
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csChFnd80/07131713162D

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M  END
>  <Mol_ID> (346)
346

>  <Formula> (346)
C56H87NO16

>  <MolWeight> (346)
1030.28708

>  <Item Name> (346)
Temsirolimus (CCI-779, NSC 683864)

>  <Catalog Number> (346)
S1044

>  <Synonyms> (346)
N/A

>  <Target> (346)
mTOR

>  <Form> (346)
Free Base

>  <URL> (346)
http://www.selleckchem.com/products/Temsirolimus.html

>  <CAS Number> (346)
162635-04-3

>  <ALogP> (346)
6.039

>  <HBA_Count> (346)
12

>  <HBD_Count> (346)
3

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11

>  <Name> (346)
Temsirolimus.cdx

$$$$
GNE-9605.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (347)
347

>  <Formula> (347)
C17H20ClF4N7O

>  <MolWeight> (347)
449.8336128

>  <Item Name> (347)
GNE-9605

>  <Catalog Number> (347)
S7368

>  <Synonyms> (347)
N/A

>  <Target> (347)
LRRK2

>  <Form> (347)
Free Base

>  <URL> (347)
http://www.selleckchem.com/products/gne-9605.html

>  <CAS Number> (347)
1536200-31-3

>  <ALogP> (347)
2.715

>  <HBA_Count> (347)
4

>  <HBD_Count> (347)
2

>  <Num_RotatableBonds> (347)
6

>  <Name> (347)
GNE-9605.cdx

$$$$
filgotinib.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (348)
348

>  <Formula> (348)
C21H23N5O3S

>  <MolWeight> (348)
425.50402

>  <Item Name> (348)
Filgotinib£¨GLPG0643)

>  <Catalog Number> (348)
S7605

>  <Synonyms> (348)
N/A

>  <Target> (348)
JAK

>  <Form> (348)
Free Base

>  <URL> (348)
http://www.selleckchem.com/products/filgotinib.html

>  <CAS Number> (348)
1206161-97-8

>  <ALogP> (348)
2.461

>  <HBA_Count> (348)
5

>  <HBD_Count> (348)
1

>  <Num_RotatableBonds> (348)
5

>  <Name> (348)
filgotinib.cdx

$$$$
Anacardic Acid.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (349)
349

>  <Formula> (349)
C22H36O3

>  <MolWeight> (349)
348.51944

>  <Item Name> (349)
Anacardic Acid

>  <Catalog Number> (349)
S7582

>  <Synonyms> (349)
6-pentadecylsalicylic Acid

>  <Target> (349)
Histone Acetyltransferase

>  <Form> (349)
Free Base

>  <URL> (349)
http://www.selleckchem.com/products/anacardic-acid.html

>  <CAS Number> (349)
16611-84-0

>  <ALogP> (349)
8.09

>  <HBA_Count> (349)
1

>  <HBD_Count> (349)
1

>  <Num_RotatableBonds> (349)
15

>  <Name> (349)
Anacardic Acid.cdx

$$$$
URMC-099.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (367)
367

>  <Formula> (367)
C22H21N3O3S

>  <MolWeight> (367)
407.48544

>  <Item Name> (367)
ANA-12

>  <Catalog Number> (367)
S7745

>  <Synonyms> (367)
N/A

>  <Target> (367)
Trk receptor

>  <Form> (367)
Free Base

>  <URL> (367)
http://www.selleckchem.com/products/ana-12.html

>  <CAS Number> (367)
219766-25-3

>  <ALogP> (367)
3.088

>  <HBA_Count> (367)
3

>  <HBD_Count> (367)
3

>  <Num_RotatableBonds> (367)
4

>  <Name> (367)
ANA-12.cdx

$$$$
PF-2341066.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (368)
368

>  <Formula> (368)
C21H22Cl2FN5O

>  <MolWeight> (368)
450.3366832

>  <Item Name> (368)
Crizotinib (PF-02341066)

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S1068

>  <Synonyms> (368)
N/A

>  <Target> (368)
c-Met, ALK

>  <Form> (368)
Free Base

>  <URL> (368)
http://www.selleckchem.com/products/PF-2341066.html

>  <CAS Number> (368)
877399-52-5, 877399-53-6 (acetate)

>  <ALogP> (368)
3.693

>  <HBA_Count> (368)
3

>  <HBD_Count> (368)
2

>  <Num_RotatableBonds> (368)
5

>  <Name> (368)
PF-2341066.cdx

$$$$
PD-0332991 hydrochloride.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (369)
369

>  <Formula> (369)
C24H30ClN7O2

>  <MolWeight> (369)
483.9937

>  <Item Name> (369)
PD 0332991 (Palbociclib) HCl

>  <Catalog Number> (369)
S1116

>  <Synonyms> (369)
N/A

>  <Target> (369)
CDK

>  <Form> (369)
Hydrochloride

>  <URL> (369)
http://www.selleckchem.com/products/PD-0332991.html

>  <CAS Number> (369)
827022-32-2, 571190-30-2 (free base)

>  <ALogP> (369)
3.183

>  <HBA_Count> (369)
5

>  <HBD_Count> (369)
2

>  <Num_RotatableBonds> (369)
5

>  <Name> (369)
PD-0332991 hydrochloride.cdx

$$$$
FRAX597.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (370)
370

>  <Formula> (370)
C29H28ClN7OS

>  <MolWeight> (370)
558.09692

>  <Item Name> (370)
FRAX597

>  <Catalog Number> (370)
S7271

>  <Synonyms> (370)
N/A

>  <Target> (370)
PAK

>  <Form> (370)
Free Base

>  <URL> (370)
http://www.selleckchem.com/products/frax597.html

>  <CAS Number> (370)
1286739-19-2

>  <ALogP> (370)
5.166

>  <HBA_Count> (370)
4

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1

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>  <Name> (370)
FRAX597.cdx

$$$$
Ro-3306.cdx
csChFnd80/07131713162D

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M  END
>  <Mol_ID> (371)
371

>  <Formula> (371)
C18H13N3OS2

>  <MolWeight> (371)
351.44532

>  <Item Name> (371)
Ro-3306

>  <Catalog Number> (371)
S7747

>  <Synonyms> (371)
N/A

>  <Target> (371)
CDK

>  <Form> (371)
Free Base

>  <URL> (371)
http://www.selleckchem.com/products/ro-3306.html

>  <CAS Number> (371)
872573-93-8

>  <ALogP> (371)
3.712

>  <HBA_Count> (371)
3

>  <HBD_Count> (371)
1

>  <Num_RotatableBonds> (371)
4

>  <Name> (371)
Ro-3306.cdx

$$$$
LDN-214117.cdx
csChFnd80/07131713162D

 31 34  0  0  0  0  0  0  0  0999 V2000
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 14  8  1  0  0  0  0
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M  END
>  <Mol_ID> (372)
372

>  <Formula> (372)
C25H29N3O3

>  <MolWeight> (372)
419.51606

>  <Item Name> (372)
LDN-214117

>  <Catalog Number> (372)
S7627

>  <Synonyms> (372)
N/A

>  <Target> (372)
TGF-beta/Smad

>  <Form> (372)
Free Base

>  <URL> (372)
http://www.selleckchem.com/products/ldn-214117.html

>  <CAS Number> (372)
1627503-67-6

>  <ALogP> (372)
3.533

>  <HBA_Count> (372)
4

>  <HBD_Count> (372)
1

>  <Num_RotatableBonds> (372)
6

>  <Name> (372)
LDN-214117.cdx

$$$$
Purvalanol A.cdx
csChFnd80/07131713162D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (373)
373

>  <Formula> (373)
C19H25ClN6O

>  <MolWeight> (373)
388.8944

>  <Item Name> (373)
Purvalanol A

>  <Catalog Number> (373)
S7793

>  <Synonyms> (373)
N/A

>  <Target> (373)
CDK

>  <Form> (373)
Free Base

>  <URL> (373)
http://www.selleckchem.com/products/purvalanol-a.html

>  <CAS Number> (373)
212844-53-6

>  <ALogP> (373)
4.462

>  <HBA_Count> (373)
3

>  <HBD_Count> (373)
3

>  <Num_RotatableBonds> (373)
7

>  <Name> (373)
Purvalanol A.cdx

$$$$
AZD2932.cdx
csChFnd80/07131713162D

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>  <Target> (378)
AMPK

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Free Base

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1613724-42-7

>  <ALogP> (378)
2.993

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HTH-01-015.cdx

$$$$
GDC-0973(XL518,RG7420.cdx
csChFnd80/07131713162D

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379

>  <Formula> (379)
C21H21F3IN3O2

>  <MolWeight> (379)
531.3100196

>  <Item Name> (379)
Cobimetinib (GDC-0973, RG7420)

>  <Catalog Number> (379)
S8041

>  <Synonyms> (379)
XL518

>  <Target> (379)
MEK

>  <Form> (379)
Free Base

>  <URL> (379)
http://www.selleckchem.com/products/cobimetinib-gdc-0973-rg7420.html

>  <CAS Number> (379)
934660-93-2

>  <ALogP> (379)
3.701

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GDC-0973(XL518,RG7420.cdx

$$$$
BVD-523.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (380)
380

>  <Formula> (380)
C21H22Cl2N4O2

>  <MolWeight> (380)
433.33098

>  <Item Name> (380)
Ulixertinib (BVD-523, VRT752271)

>  <Catalog Number> (380)
S7854

>  <Synonyms> (380)
N/A

>  <Target> (380)
ERK

>  <Form> (380)
Free Base

>  <URL> (380)
http://www.selleckchem.com/products/ulixertinib-bvd-523-vrt752271.html

>  <CAS Number> (380)
869886-67-9

>  <ALogP> (380)
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4

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BVD-523.cdx

$$$$
KN-93 H3PO4.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (381)
381

>  <Formula> (381)
C26H32ClN2O8PS

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>  <Item Name> (381)
KN-93 Phosphate

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>  <Target> (381)
CaMK

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Free Base

>  <URL> (381)
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KN-93 H3PO4.cdx

$$$$
ONO-4059.cdx
csChFnd80/07131713162D

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CDK

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flavopiridol.cdx

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Tideglusib.cdx
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C24H22O6

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Palomid 529

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S2238

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P529

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mTOR

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Free Base

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914913-88-5

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P529.cdx

$$$$
Daphnetin.cdx
csChFnd80/07131713162D

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C9H6O4

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Daphnetin

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S2554

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N/A

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DNA/RNA Synthesis

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Free Base

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486-35-1

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Daphnetin.cdx

$$$$
CAY10505.cdx
csChFnd80/07131713162D

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403

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C14H8FNO3S

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CAY10505

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PI3K

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Free Base

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1218777-13-9

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CAY10505.cdx

$$$$
Chloroquine phosphate.cdx
csChFnd80/07131713162D

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404

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C18H32ClN3O8P2

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Chloroquine Phosphate

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S4157

>  <Synonyms> (403)
N/A

>  <Target> (403)
Others

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Diphosphate

>  <URL> (403)
http://www.selleckchem.com/products/chloroquine-phosphate.html

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50-63-5

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Chloroquine phosphate.cdx

$$$$
Dorsomorphin dihydrochloride(BML-275,Compound C).cdx
csChFnd80/07131713162D

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405

>  <Formula> (404)
C24H27Cl2N5O

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>  <Item Name> (404)
Dorsomorphin (Compound C) 2HCl

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S7306

>  <Synonyms> (404)
BML-275,Compound C

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AMPK

>  <Form> (404)
Dihydrochloride

>  <URL> (404)
http://www.selleckchem.com/products/dorsomorphin-2hcl.html

>  <CAS Number> (404)
1219168-18-9

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3.792

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>  <Name> (404)
Dorsomorphin dihydrochloride(BML-275,Compound C).cdx

$$$$
ASP3026   structure.cdx
csChFnd80/07131713162D

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EGFR

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S6 Kinase

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LJI308.cdx

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mTOR

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csChFnd80/07131713162D

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GSK2141795.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (413)
414

>  <Formula> (413)
C18H16Cl2F2N4O2

>  <MolWeight> (413)
429.2480464

>  <Item Name> (413)
Uprosertib (GSK2141795)

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S7492

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GSK795

>  <Target> (413)
Akt

>  <Form> (413)
Free Base

>  <URL> (413)
http://www.selleckchem.com/products/gsk2141795.html

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1047634-65-0

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3.531

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3

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2

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6

>  <Name> (413)
GSK2141795.cdx

$$$$
VPS34-IN1.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (414)
415

>  <Formula> (414)
C21H24ClN7O

>  <MolWeight> (414)
425.91456

>  <Item Name> (414)
VPS34-IN1

>  <Catalog Number> (414)
S7980

>  <Synonyms> (414)
Vps34-IN-1

>  <Target> (414)
PI3K

>  <Form> (414)
Free Base

>  <URL> (414)
http://www.selleckchem.com/products/vps34-in1.html

>  <CAS Number> (414)
1383716-33-3

>  <ALogP> (414)
3.672

>  <HBA_Count> (414)
5

>  <HBD_Count> (414)
2

>  <Num_RotatableBonds> (414)
8

>  <Name> (414)
VPS34-IN1.cdx

$$$$
Oclacitinib maleate.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (415)
416

>  <Formula> (415)
C19H27N5O6S

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453.51258

>  <Item Name> (415)
Oclacitinib maleate

>  <Catalog Number> (415)
S8195

>  <Synonyms> (415)
PF-03394197

>  <Target> (415)
JAK

>  <Form> (415)
maleate

>  <URL> (415)
http://www.selleckchem.com/products/oclacitinib-maleate.html

>  <CAS Number> (415)
1640292-55-2

>  <ALogP> (415)
1.758

>  <HBA_Count> (415)
6

>  <HBD_Count> (415)
2

>  <Num_RotatableBonds> (415)
7

>  <Name> (415)
Oclacitinib maleate.cdx

$$$$
MLN2480.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (416)
417

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C17H12Cl2F3N7O2S

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MLN2480

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BIIB-024

>  <Target> (416)
Raf

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Free Base

>  <URL> (416)
http://www.selleckchem.com/products/mln2480.html

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1096708-71-2

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>  <Name> (416)
MLN2480.cdx

$$$$
BMS-582949.cdx
csChFnd80/07131713162D

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csChFnd80/07131713162D

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>  <Mol_ID> (427)
428

>  <Formula> (427)
C15H10O4

>  <MolWeight> (427)
254.2375

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7,8-Dihydroxyflavone

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S8319

>  <Synonyms> (427)
7,8-DHF

>  <Target> (427)
Trk receptor

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Free Base

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http://www.selleckchem.com/products/7-8-dihydroxyflavone.html

>  <CAS Number> (427)
38183-03-8

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2.652

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2

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2

>  <Num_RotatableBonds> (427)
1

>  <Name> (427)
7,8-Dihydroxyflavone.cdx

$$$$
LY3023414.cdx
csChFnd80/07131713162D

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429

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C23H26N4O3

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LY3023414

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S8322

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GTPL8918

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Akt

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Free Base

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http://www.selleckchem.com/products/ly3023414.html

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1386874-06-1

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1.883

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4

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0

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LY3023414.cdx

$$$$
untitled.cdx
csChFnd80/07131713162D

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>  <Mol_ID> (429)
431

>  <Formula> (429)
C53H84NO14P

>  <MolWeight> (429)
990.206121

>  <Item Name> (429)
Deforolimus (MK-8669) 

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S1022

>  <Synonyms> (429)
AP23573, MK-8669

>  <Target> (429)
mTOR

>  <Form> (429)
Free Base

>  <URL> (429)
http://www.selleckchem.com/products/Deforolimus.html

>  <CAS Number> (429)
572924-54-0

>  <ALogP> (429)
6.303

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12

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1

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8

$$$$
