IAP
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AT406 (SM-406)CAS号: 1071992-99-8分子式: C32H43N5O4 分子量: 561.71IUPAC Name: (5S,8S,10aR)-N-benzhydryl-5-[[(2S)-2-(methylamino)propanoyl]amino]-3-(3-methylbutanoyl)-6-oxo-1,2,4,5,8,9,10,10a-octahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamideSMILES: CC(C)CC(=O)N1CCC2CCC(N2C(=O)C(C1)NC(=O)C(C)NC)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4InChIKey: LSXUTRRVVSPWDZ-MKKUMYSQSA-NInChI: See more
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Birinapant,cIAP1和XIAP拮抗剂CAS号: 1260251-31-7分子式: C42H56F2N8O6 分子量: 806.94IUPAC Name: See moreSMILES: CCC(C(=O)N1CC(CC1CC2=C(NC3=C2C=CC(=C3)F)C4=C(C5=C(N4)C=C(C=C5)F)CC6CC(CN6C(=O)C(CC)NC(=O)C(C)NC)O)O)NC(=O)C(C)NCInChIKey: PKWRMUKBEYJEIX-DXXQBUJASA-NInChI: See more
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GDC-0152CAS号: 873652-48-3分子式: C25H34N6O3S 分子量: 498.64IUPAC Name: (2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-N-(4-phenylthiadiazol-5-yl)pyrrolidine-2-carboxamideSMILES: CC(C(=O)NC(C1CCCCC1)C(=O)N2CCCC2C(=O)NC3=C(N=NS3)C4=CC=CC=C4)NCInChIKey: WZRFLSDVFPIXOV-LRQRDZAKSA-NInChI: See more
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LCL161,抑制剂CAS号: 1005342-46-0分子式: C26H33FN4O3S 分子量: 500.63IUPAC Name: (2S)-N-[(1S)-1-cyclohexyl-2-[(2S)-2-[4-(4-fluorobenzoyl)-1,3-thiazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]-2-(methylamino)propanamideSMILES: CC(C(=O)NC(C1CCCCC1)C(=O)N2CCCC2C3=NC(=CS3)C(=O)C4=CC=C(C=C4)F)NCInChIKey: UFPFGVNKHCLJJO-SSKFGXFMSA-NInChI: 1S/C26H33FN4O3S/c1-16(28-2)24(33)30-22(17-7-4-3-5-8-17)26(34)31-14-6-9-21(31)25-29-20(15-35-25)23(32)18-10-12-19(27)13-11-18/h10-13,15-17,21-22,28H,3-9,14H2,1-2H3,(H,30,33)/t16-,21-,22-/m0/s1
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UC 112,IAP和XIAP抑制剂CAS号: 383392-66-3 Compound CID : 3426979分子式: C22H24N2O2 分子量: 348.44IUPAC Name: 5-(phenylmethoxymethyl)-7-(pyrrolidin-1-ylmethyl)quinolin-8-olSMILES: C1CCN(C1)CC2=CC(=C3C=CC=NC3=C2O)COCC4=CC=CC=C4InChIKey: LTGLGIQQZXSLLF-UHFFFAOYSA-NInChI: 1S/C22H24N2O2/c25-22-18(14-24-11-4-5-12-24)13-19(20-9-6-10-23-21(20)22)16-26-15-17-7-2-1-3-8-17/h1-3,6-10,13,25H,4-5,11-12,14-16H2
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AZD 5582 二盐酸盐CAS号: 1883545-51-4 Compound CID : 90489014分子式: C58H78N8O8.2HCl 分子量: 1088.21IUPAC Name: See moreSMILES: CC(C(=O)NC(C1CCCCC1)C(=O)N2CCCC2C(=O)NC3C(CC4=CC=CC=C34)OCC#CC#CCOC5CC6=CC=CC=C6C5NC(=O)C7CCCN7C(=O)C(C8CCCCC8)NC(=O)C(C)NC)NC.Cl.ClInChIKey: DAILKFFMJFAUCE-GXSVUDMFSA-NInChI: See more
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A 410099.1,XIAP拮抗剂CAS号: 762274-58-8 Compound CID : 131858992分子式: C27H40N4O3·HCl 分子量: 505.09SMILES: CN[C@H](C(N[C@H](C(N1CCC[C@H]1C(N[C@@H]2CCCC3=CC=CC=C23)=O)=O)C4CCCCC4)=O)C.ClInChIKey: OPCYOBWCDDJCFT-VOSOYEAFSA-N
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SM-164CAS号: 957135-43-2 Compound CID : 17756618分子式: C62H84N14O6 分子量: 1121.42IUPAC Name: See moreSMILES: CC(C(=O)NC1CCCCC2CCC(N2C1=O)C(=O)NC(C3=CC=CC=C3)C4=CN(N=N4)CCCCC5=CC=C(C=C5)CCCCN6C=C(N=N6)C(C7=CC=CC=C7)NC(=O)C8CCC9N8C(=O)C(CCCC9)NC(=O)C(C)NC)NCInChIKey: LGYDZXNSSLRFJS-IOQQVAQYSA-NInChI: See more
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AZD5582CAS号: 1258392-53-8分子式: C58H78N8O8 分子量: 1015.29IUPAC Name: See moreSMILES: CC(C(=O)NC(C1CCCCC1)C(=O)N2CCCC2C(=O)NC3C(CC4=CC=CC=C34)OCC#CC#CCOC5CC6=CC=CC=C6C5NC(=O)C7CCCN7C(=O)C(C8CCCCC8)NC(=O)C(C)NC)NCInChIKey: WLMCRYCCYXHPQF-ZVMUOSSASA-NInChI: See more
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MX69CAS号: 1005264-47-0分子式: C27H26N2O4S 分子量: 474.57IUPAC Name: 4-[8-[(3,4-dimethylphenyl)sulfamoyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]benzoic acidSMILES: CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(C4C3C=CC4)C5=CC=C(C=C5)C(=O)O)CInChIKey: XCBONKHCCRJMNW-UHFFFAOYSA-NInChI: 1S/C27H26N2O4S/c1-16-6-11-20(14-17(16)2)29-34(32,33)21-12-13-25-24(15-21)22-4-3-5-23(22)26(28-25)18-7-9-19(10-8-18)27(30)31/h3-4,6-15,22-23,26,28-29H,5H2,1-2H3,(H,30,31)
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Tolinapant (ASTX660)CAS号: 1799328-86-1 Compound CID : 118169620分子式: C3OH42FN5O3 分子量: 539.68IUPAC Name: 1-[6-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-3,3-dimethyl-2H-pyrrolo[3,2-b]pyridin-1-yl]-2-[(2R,5R)-5-methyl-2-[[(3R)-3-methylmorpholin-4-yl]methyl]piperazin-1-yl]ethanoneSMILES: CC1CN(C(CN1)CN2CCOCC2C)CC(=O)N3CC(C4=C3C=C(C(=N4)CO)CC5=CC=C(C=C5)F)(C)CInChIKey: YCXOHEXZVKOGEV-DNRQZRRGSA-NInChI: 1S/C30H42FN5O3/c1-20-14-35(25(13-32-20)15-34-9-10-39-18-21(34)2)16-28(38)36-19-30(3,4)29-27(36)12-23(26(17-37)33-29)11-22-5-7-24(31)8-6-22/h5-8,12,20-21,25,32,37H,9-11,13-19H2,1-4H3/t20-,21-,25-/m1/s1
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