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E1/E2/E3酶
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Nutlin-3CAS号: 890090-75-2分子式: C30H30Cl2N4O4 分子量: 581.49IUPAC Name: 4-[4,5-bis(4-chlorophenyl)-2-(4-methoxy-2-propan-2-yloxyphenyl)-4,5-dihydroimidazole-1-carbonyl]piperazin-2-oneSMILES: CC(C)OC1=C(C=CC(=C1)OC)C2=NC(C(N2C(=O)N3CCNC(=O)C3)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)ClInChIKey: BDUHCSBCVGXTJM-UHFFFAOYSA-NInChI: 1S/C30H30Cl2N4O4/c1-18(2)40-25-16-23(39-3)12-13-24(25)29-34-27(19-4-8-21(31)9-5-19)28(20-6-10-22(32)11-7-20)36(29)30(38)35-15-14-33-26(37)17-35/h4-13,16,18,27-28H,14-15,17H2,1-3H3,(H,33,37)
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Nutlin-3a,p53-MDM2结合抑制剂CAS号: 675576-98-4分子式: C30H30Cl2N4O4 分子量: 581.49IUPAC Name: 4-[(4S,5R)-4,5-bis(4-chlorophenyl)-2-(4-methoxy-2-propan-2-yloxyphenyl)-4,5-dihydroimidazole-1-carbonyl]piperazin-2-oneSMILES: CC(C)OC1=C(C=CC(=C1)OC)C2=NC(C(N2C(=O)N3CCNC(=O)C3)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)ClInChIKey: BDUHCSBCVGXTJM-WUFINQPMSA-NInChI: See more
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BC-1382,泛素E3连接酶铰接酶溶酶诱导剂CAS号: 1013753-99-5 Compound CID : 17585104分子式: C23H29N3O5S 分子量: 459.558IUPAC Name: 1-(benzenesulfonyl)-N-[(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl]piperidine-4-carboxamideSMILES: CC(C(=O)NCC1=CC=CC=C1OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3InChIKey: RCWXKFCEGKXUIN-KRWDZBQOSA-NInChI: 1S/C23H29N3O5S/c1-17(22(27)24-16-19-8-6-7-11-21(19)31-2)25-23(28)18-12-14-26(15-13-18)32(29,30)20-9-4-3-5-10-20/h3-11,17-18H,12-16H2,1-2H3,(H,24,27)(H,25,28)/t17-/m0/s1
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3-(4-氯苯基)-1,2,4-三唑-5-硫醇CAS号: 26028-65-9分子式: C8H6ClN3S 分子量: 211.67IUPAC Name: 5-(4-chlorophenyl)-1,2-dihydro-1,2,4-triazole-3-thioneSMILES: C1=CC(=CC=C1C2=NC(=S)NN2)ClInChIKey: NHEHIODVWGKDFV-UHFFFAOYSA-NInChI: 1S/C8H6ClN3S/c9-6-3-1-5(2-4-6)7-10-8(13)12-11-7/h1-4H,(H2,10,11,12,13)
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BH3I-1CAS号: 300817-68-9分子式: C15H14BrNO3S2 分子量: 400.3IUPAC Name: 2-[(5E)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methylbutanoic acidSMILES: CC(C)C(C(=O)O)N1C(=O)C(=CC2=CC=C(C=C2)Br)SC1=SInChIKey: COHIEJLWRGREHV-YRNVUSSQSA-NInChI: 1S/C15H14BrNO3S2/c1-8(2)12(14(19)20)17-13(18)11(22-15(17)21)7-9-3-5-10(16)6-4-9/h3-8,12H,1-2H3,(H,19,20)/b11-7+
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TAK-243 (MLN7243)CAS号: 1450833-55-2 Compound CID : 71715374分子式: C19H20F3N5O5S2 分子量: 519.52IUPAC Name: [(1R,2R,3S,4R)-2,3-dihydroxy-4-[[2-[3-(trifluoromethylsulfanyl)phenyl]pyrazolo[1,5-a]pyrimidin-7-yl]amino]cyclopentyl]methyl sulfamateSMILES: C1C(C(C(C1NC2=CC=NC3=CC(=NN23)C4=CC(=CC=C4)SC(F)(F)F)O)O)COS(=O)(=O)NInChIKey: KJDAGXLMHXUAGV-DGWLBADLSA-NInChI: 1S/C19H20F3N5O5S2/c20-19(21,22)33-12-3-1-2-10(6-12)13-8-16-24-5-4-15(27(16)26-13)25-14-7-11(17(28)18(14)29)9-32-34(23,30)31/h1-6,8,11,14,17-18,25,28-29H,7,9H2,(H2,23,30,31)/t11-,14-,17-,18+/m1/s1
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MI-1061 TFACAS号: 1410737-35-7分子式: C32H27Cl2F4N3O6 分子量: 696.47SMILES: O=C(O)C1=CC=C(NC([C@H](N2)[C@H](C3=CC=CC(Cl)=C3F)[C@]4(C(NC5=C4C=CC(Cl)=C5)=O)C62CCCCC6)=O)C=C1.OC(C(F)(F)F)=O
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