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AP26113-analog (ALK-IN-1)
- 10mM in DMSO
CAS号: 1197958-12-5

分子式: C₂₆H₃₄ClN₆O₂P 分子量: 529.01
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Crizotinib (PF-02341066)
- 10mM in DMSO
CAS号: 877399-52-5

分子式: C₂₁H₂₂Cl₂FN₅O 分子量: 450.34

IUPAC Name: 3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine

SMILES: CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)C3=CN(N=C3)C4CCNCC4)N

InChIKey: KTEIFNKAUNYNJU-GFCCVEGCSA-N

InChI: 1S/C21H22Cl2FN5O/c1-12(19-16(22)2-3-17(24)20(19)23)30-18-8-13(9-27-21(18)25)14-10-28-29(11-14)15-4-6-26-7-5-15/h2-3,8-12,15,26H,4-7H2,1H3,(H2,25,27)/t12-/m1/s1
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Entrectinib (RXDX-101)
- 10mM in DMSO
CAS号: 1108743-60-7

分子式: C₃₁H₃₄F₂N₆O₂ 分子量: 560.64
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GSK1838705A
- 10mM in DMSO
CAS号: 1116235-97-2

分子式: C₂₇H₂₉FN₈O₃ 分子量: 532.57
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TAE226 (NVP-TAE226)
- 10mM in DMSO
CAS号: 761437-28-9 Compound CID : 9934347

分子式: C₂₃H₂₅ClN₆O₃ 分子量: 468.94
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TAE684 (NVP-TAE684)
- 2mM in DMSO
CAS号: 761439-42-3 Compound CID : 16038120

分子式: C₃₀H₄₀ClN₇O₃S 分子量: 614.2
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劳拉替尼
- 10mM in DMSO
CAS号: 1454846-35-5 Compound CID : 71731823

分子式: C₂₁H₁₉FN₆O₂ 分子量: 406.41
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N-[4-(4-氨基-1-哌啶基)-2-甲氧基苯基]-5-氯-4-(1H-吲哚-3-基)-2-嘧啶胺
- 10mM in DMSO
CAS号: 1356962-20-3

分子式: C₂₄H₂₅ClN₆O 分子量: 448.95

IUPAC Name: N-[4-(4-aminopiperidin-1-yl)-2-methoxyphenyl]-5-chloro-4-(1H-indol-3-yl)pyrimidin-2-amine

SMILES: COC1=C(C=CC(=C1)N2CCC(CC2)N)NC3=NC=C(C(=N3)C4=CNC5=CC=CC=C54)Cl

InChIKey: GCYIGMXOIWJGBU-UHFFFAOYSA-N

InChI: 1S/C24H25ClN6O/c1-32-22-12-16(31-10-8-15(26)9-11-31)6-7-21(22)29-24-28-14-19(25)23(30-24)18-13-27-20-5-3-2-4-17(18)20/h2-7,12-15,27H,8-11,26H2,1H3,(H,28,29,30)
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布里加蒂尼(AP26113)
- 2mM in DMSO
CAS号: 1197953-54-0

分子式: C₂₉H₃₉ClN₇O₂P 分子量: 584.09

IUPAC Name: 5-chloro-4-N-(2-dimethylphosphorylphenyl)-2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrimidine-2,4-diamine

SMILES: CN1CCN(CC1)C2CCN(CC2)C3=CC(=C(C=C3)NC4=NC=C(C(=N4)NC5=CC=CC=C5P(=O)(C)C)Cl)OC

InChIKey: AILRADAXUVEEIR-UHFFFAOYSA-N

InChI: 1S/C29H39ClN7O2P/c1-35-15-17-37(18-16-35)21-11-13-36(14-12-21)22-9-10-24(26(19-22)39-2)33-29-31-20-23(30)28(34-29)32-25-7-5-6-8-27(25)40(3,4)38/h5-10,19-21H,11-18H2,1-4H3,(H2,31,32,33,34)
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贝扎替尼(TSR-011)
- 10mM in DMSO
CAS号: 1357920-84-3

分子式: C₃₃H₄₄FN₅O₃ 分子量: 577.73

IUPAC Name: 4-fluoro-N-[6-[[4-(2-hydroxypropan-2-yl)piperidin-1-yl]methyl]-1-[4-(propan-2-ylcarbamoyl)cyclohexyl]benzimidazol-2-yl]benzamide

SMILES: CC(C)NC(=O)C1CCC(CC1)N2C3=C(C=CC(=C3)CN4CCC(CC4)C(C)(C)O)N=C2NC(=O)C5=CC=C(C=C5)F

InChIKey: WSTUJEXAPHIEIM-UHFFFAOYSA-N

InChI: 1S/C33H44FN5O3/c1-21(2)35-30(40)24-8-12-27(13-9-24)39-29-19-22(20-38-17-15-25(16-18-38)33(3,4)42)5-14-28(29)36-32(39)37-31(41)23-6-10-26(34)11-7-23/h5-7,10-11,14,19,21,24-25,27,42H,8-9,12-13,15-18,20HSee more
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Gilteritinib
- 10mM in DMSO
CAS号: 1254053-43-4

分子式: C₂₉H₄₄N₈O₃ 分子量: 552.7115

IUPAC Name: 6-ethyl-3-[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]anilino]-5-(oxan-4-ylamino)pyrazine-2-carboxamide

SMILES: CCC1=C(N=C(C(=N1)C(=O)N)NC2=CC(=C(C=C2)N3CCC(CC3)N4CCN(CC4)C)OC)NC5CCOCC5

InChIKey: GYQYAJJFPNQOOW-UHFFFAOYSA-N

InChI: 1S/C29H44N8O3/c1-4-23-28(31-20-9-17-40-18-10-20)34-29(26(33-23)27(30)38)32-21-5-6-24(25(19-21)39-3)37-11-7-22(8-12-37)36-15-13-35(2)14-16-36/h5-6,19-20,22H,4,7-18H2,1-3H3,(H2,30,38)(H2,31,32,34)
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HS-1371
- 10mM in DMSO
CAS号: 2158197-70-5

分子式: C₂₄H₂₄N₄O 分子量: 384.47

IUPAC Name: 4-(4-methylphenoxy)-7-(1-piperidin-4-ylpyrazol-4-yl)quinoline

SMILES: CC1=CC=C(C=C1)OC2=C3C=CC(=CC3=NC=C2)C4=CN(N=C4)C5CCNCC5

InChIKey: VPVLPCIBKVWFDT-UHFFFAOYSA-N

InChI: 1S/C24H24N4O/c1-17-2-5-21(6-3-17)29-24-10-13-26-23-14-18(4-7-22(23)24)19-15-27-28(16-19)20-8-11-25-12-9-20/h2-7,10,13-16,20,25H,8-9,11-12H2,1H3
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