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塞马西尼CAS号 : 204005-46-9分子式: C15H14N2O 分子量: 238.28IUPAC Name: (3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-1H-indol-2-oneSMILES: CC1=CC(=C(N1)C=C2C3=CC=CC=C3NC2=O)CInChIKey: WUWDLXZGHZSWQZ-WQLSENKSSA-NInChI: InChI=1S/C15H14N2O/c1-9-7-10(2)16-14(9)8-12-11-5-3-4-6-13(11)17-15(12)18/h3-8,16H,1-2H3,(H,17,18)/b12-8-
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CYM 50260,S1P4激动剂CAS号 : 1355026-60-6 Compound CID : 44620894分子式: C14H11Cl3FNO2 分子量: 350.6IUPAC Name: 2-chloro-3-[2-(2,4-dichlorophenoxy)ethoxy]-6-(fluoromethyl)pyridineSMILES: C1=CC(=C(C=C1Cl)Cl)OCCOC2=C(N=C(C=C2)CF)ClInChIKey: FHPOTBQOUBMMCI-UHFFFAOYSA-NInChI: InChI=1S/C14H11Cl3FNO2/c15-9-1-3-12(11(16)7-9)20-5-6-21-13-4-2-10(8-18)19-14(13)17/h1-4,7H,5-6,8H2
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CS 2100,S1P1激动剂CAS号 : 913827-99-3 Compound CID : 11977938分子式: C25H23N3O4S 分子量: 461.53IUPAC Name: 1-[[4-ethyl-5-[5-(4-phenoxyphenyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]azetidine-3-carboxylic acidSMILES: CCC1=C(SC(=C1)CN2CC(C2)C(=O)O)C3=NOC(=N3)C4=CC=C(C=C4)OC5=CC=CC=C5InChIKey: DWVJASHDNJMDNH-UHFFFAOYSA-NInChI: InChI=1S/C25H23N3O4S/c1-2-16-12-21(15-28-13-18(14-28)25(29)30)33-22(16)23-26-24(32-27-23)17-8-10-20(11-9-17)31-19-6-4-3-5-7-19/h3-12,18H,2,13-15H2,1H3,(H,29,30)
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BLZ945CAS号 : 953769-46-5(DMSO)分子式: C20H22N4O3S 分子量: 398.48SMILES: CNC(=O)C1=NC=CC(=C1)OC2=CC3=C(C=C2)N=C(NC4CCCCC4O)S3
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Barasertib (AZD1152-HQPA)CAS号 : 722544-51-6(DMSO)分子式: C26H30FN7O3 分子量: 507.56SMILES: CCN(CCO)CCCOC1=CC=C2C(=NC=NC2=C1)NC3=CC(=N[NH]3)CC(=O)NC4=CC=CC(=C4)F
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Brivanib (BMS-540215)CAS号 : 649735-46-6(DMSO)分子式: C19H19FN4O3 分子量: 370.38SMILES: CC(O)COC1=C[N]2N=CN=C(OC3=C(F)C4=C([NH]C(=C4)C)C=C3)C2=C1C
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Agerafenib (RXDX-105)CAS号 : 1188910-76-0(DMSO)分子式: C24H22F3N5O5 分子量: 517.46SMILES: COC1=CC2=NC=NC(=C2C=C1OC)OC3=CC(=CC=C3)NC(=O)NC4=NOC(=C4)C(C)(C)C(F)(F)F
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CP-673451CAS号 : 343787-29-1(DMSO)分子式: C24H27N5O2 分子量: 417.5SMILES: COCCOC1=CC=C2[N](C=NC2=C1)C3=NC4=C(C=CC=C4C=C3)N5CCC(N)CC5
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Cabozantinib (BMS-907351)CAS号 : 849217-68-1(DMSO)分子式: C28H24FN3O5 分子量: 501.51SMILES: COC1=CC2=C(C=C1OC)C(=CC=N2)OC3=CC=C(NC(=O)C4(CC4)C(=O)NC5=CC=C(F)C=C5)C=C3
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Cediranib (AZD2171)CAS号 : 288383-20-0(DMSO)分子式: C25H27FN4O3 分子量: 450.51SMILES: COC1=C(OCCCN2CCCC2)C=C3N=CN=C(OC4=C(F)C5=C([NH]C(=C5)C)C=C4)C3=C1
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Dasatinib (BMS-354825)CAS号 : 302962-49-8(DMSO)分子式: C22H26ClN7O2S 分子量: 488.01SMILES: CC1=NC(=CC(=N1)N2CCN(CCO)CC2)NC3=NC=C(S3)C(=O)NC4=C(Cl)C=CC=C4C
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Dovitinib (TKI-258)CAS号 : 405169-16-6(DMSO)分子式: C21H21FN6O 分子量: 392.43SMILES: CN1CCN(CC1)C2=CC3=C(C=C2)N=C([NH]3)C4=C(N)C5=C(NC4=O)C=CC=C5F
