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BI-D1870
- 10mM in DMSO
CAS号 : 501437-28-1(DMSO)

分子式: C₁₉H₂₃F₂N₅O₂ 分子量: 391.42

SMILES: CC(C)CCN1C(C)C(=O)N(C)C2=C1N=C(NC3=CC(=C(O)C(=C3)F)F)N=C2
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Bosutinib (SKI-606)
- 10mM in DMSO
CAS号 : 380843-75-4(DMSO)

分子式: C₂₆H₂₉Cl₂N₅O₃ 分子量: 530.45

SMILES: COC1=C(Cl)C=C(Cl)C(=C1)NC2=C(C=NC3=CC(=C(OC)C=C23)OCCCN4CCN(C)CC4)C#N
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Foretinib (GSK1363089)
- 10mM in DMSO
CAS号 : 849217-64-7(DMSO)

分子式: C₃₄H₃₄F₂N₄O₆ 分子量: 632.65

SMILES: COC1=CC2=C(C=C1OCCCN3CCOCC3)N=CC=C2OC4=C(F)C=C(NC(=O)C5(CC5)C(=O)NC6=CC=C(F)C=C6)C=C4
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GSK1838705A
- 10mM in DMSO
CAS号 : 1116235-97-2(DMSO)

分子式: C₂₇H₂₉FN₈O₃ 分子量: 532.57

SMILES: CNC(=O)C1=C(F)C=CC=C1NC2=C3C=C[NH]C3=NC(=N2)NC4=C(OC)C=C5CCN(C(=O)CN(C)C)C5=C4
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GSK429286A
- 10mM in DMSO
CAS号 : 864082-47-3(DMSO)

分子式: C₂₁H₁₆F₄N₄O₂ 分子量: 432.37

SMILES: CC1=C(C(CC(=O)N1)C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=C(F)C=C4[NH]N=CC4=C3
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Ponatinib (AP24534)
- 10mM in DMSO
CAS号 : 943319-70-8(DMSO)

分子式: C₂₉H₂₇F₃N₆O 分子量: 532.56

SMILES: CN1CCN(CC1)CC2=C(C=C(NC(=O)C3=CC(=C(C)C=C3)C#CC4=CN=C5C=CC=N[N]45)C=C2)C(F)(F)F
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Bromosporine
- 10mM in DMSO
CAS号 : 1619994-69-2

分子式: C₁₇H₂₀N₆O₄S 分子量: 404.44

IUPAC Name: ethyl N-[6-[3-(methanesulfonamido)-4-methylphenyl]-3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-8-yl]carbamate

SMILES: CCOC(=O)NC1=CC(=NN2C1=NN=C2C)C3=CC(=C(C=C3)C)NS(=O)(=O)C

InChIKey: UYBRROMMFMPJAN-UHFFFAOYSA-N

InChI: InChI=1S/C17H20N6O4S/c1-5-27-17(24)18-15-9-14(21-23-11(3)19-20-16(15)23)12-7-6-10(2)13(8-12)22-28(4,25)26/h6-9,22H,5H2,1-4H3,(H,18,24)
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GSK6853
- 10mM in DMSO
CAS号 : 1910124-24-1

分子式: C₂₂H₂₇N₅O₃ 分子量: 409.48

IUPAC Name: N-[1,3-dimethyl-6-[(2R)-2-methylpiperazin-1-yl]-2-oxobenzimidazol-5-yl]-2-methoxybenzamide

SMILES: CC1CNCCN1C2=CC3=C(C=C2NC(=O)C4=CC=CC=C4OC)N(C(=O)N3C)C

InChIKey: FQWDVNSBYDXPIO-CQSZACIVSA-N

InChI: InChI=1S/C22H27N5O3/c1-14-13-23-9-10-27(14)17-12-19-18(25(2)22(29)26(19)3)11-16(17)24-21(28)15-7-5-6-8-20(15)30-4/h5-8,11-12,14,23H,9-10,13H2,1-4H3,(H,24,28)/t14-/m1/s1
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GSK 5959
- 10mM in DMSO
CAS号 : 901245-65-6

分子式: C₂₂H₂₆N₄O₃ 分子量: 394.47

IUPAC Name: N-(1,3-dimethyl-2-oxo-6-piperidin-1-ylbenzimidazol-5-yl)-2-methoxybenzamide

SMILES: CN1C2=C(C=C(C(=C2)NC(=O)C3=CC=CC=C3OC)N4CCCCC4)N(C1=O)C

InChIKey: LTUGYAOMCKNTGG-UHFFFAOYSA-N

InChI: InChI=1S/C22H26N4O3/c1-24-18-13-16(23-21(27)15-9-5-6-10-20(15)29-3)17(26-11-7-4-8-12-26)14-19(18)25(2)22(24)28/h5-6,9-10,13-14H,4,7-8,11-12H2,1-3H3,(H,23,27)
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LJH685
- 10mM in DMSO
CAS号 : 1627710-50-2

分子式: C₂₂H₂₁F₂N₃O 分子量: 381.42

IUPAC Name: 2,6-difluoro-4-[4-[4-(4-methylpiperazin-1-yl)phenyl]pyridin-3-yl]phenol

SMILES: CN1CCN(CC1)C2=CC=C(C=C2)C3=C(C=NC=C3)C4=CC(=C(C(=C4)F)O)F

InChIKey: IKUFKDGKRLMXEX-UHFFFAOYSA-N

InChI: InChI=1S/C22H21F2N3O/c1-26-8-10-27(11-9-26)17-4-2-15(3-5-17)18-6-7-25-14-19(18)16-12-20(23)22(28)21(24)13-16/h2-7,12-14,28H,8-11H2,1H3
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OF 1
- 10mM in DMSO
CAS号 : 919973-83-4

分子式: C₁₇H₁₈BrN₃O₄S 分子量: 440.31

IUPAC Name: 4-bromo-N-(6-methoxy-1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-methylbenzenesulfonamide

SMILES: CC1=C(C=CC(=C1)Br)S(=O)(=O)NC2=CC3=C(C=C2OC)N(C(=O)N3C)C

InChIKey: YUNQZQREIHWDQT-UHFFFAOYSA-N

InChI: InChI=1S/C17H18BrN3O4S/c1-10-7-11(18)5-6-16(10)26(23,24)19-12-8-13-14(9-15(12)25-4)21(3)17(22)20(13)2/h5-9,19H,1-4H3
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PD173955
- 10mM in DMSO
CAS号 : 260415-63-2 Compound CID : 447077

分子式: C₂₁H₁₆Cl₂N₄OS 分子量: 443.35

IUPAC Name: 6-(2,6-dichlorophenyl)-8-methyl-2-(3-methylsulfanylanilino)pyrido[2,3-d]pyrimidin-7-one

SMILES: CN1C2=NC(=NC=C2C=C(C1=O)C3=C(C=CC=C3Cl)Cl)NC4=CC(=CC=C4)SC

InChIKey: VAARYSWULJUGST-UHFFFAOYSA-N

InChI: InChI=1S/C21H16Cl2N4OS/c1-27-19-12(9-15(20(27)28)18-16(22)7-4-8-17(18)23)11-24-21(26-19)25-13-5-3-6-14(10-13)29-2/h3-11H,1-2H3,(H,24,25,26)
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