小分子
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Dinaciclib (SCH727965)CAS号 : 779353-01-4(DMSO)分子式: C21H28N6O2 分子量: 396.49SMILES: CCC1=C2N=C(C=C(NCC3=CC=C[N+](=C3)[O-])[N]2N=C1)N4CCCCC4CCO
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托灭酸CAS号 : 13710-19-5(DMSO)分子式: C14H12ClNO2 分子量: 261.7SMILES: CC1=C(Cl)C=CC=C1NC2=C(C=CC=C2)C(O)=O
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ASP 9521CAS号 : 1126084-37-4分子式: C19H26N2O3 分子量: 330.42IUPAC Name: [4-(2-hydroxy-2-methylpropyl)piperidin-1-yl]-(5-methoxy-1H-indol-2-yl)methanoneSMILES: CC(C)(CC1CCN(CC1)C(=O)C2=CC3=C(N2)C=CC(=C3)OC)OInChIKey: OXSCPDKUZWPWFR-UHFFFAOYSA-NInChI: InChI=1S/C19H26N2O3/c1-19(2,23)12-13-6-8-21(9-7-13)18(22)17-11-14-10-15(24-3)4-5-16(14)20-17/h4-5,10-11,13,20,23H,6-9,12H2,1-3H3
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AMG 333CAS号 : 1416799-28-4分子式: C20H12F5N3O4 分子量: 453.33IUPAC Name: 6-[[(S)-(3-fluoropyridin-2-yl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methyl]carbamoyl]pyridine-3-carboxylic acidSMILES: C1=CC(=C(N=C1)C(C2=CC(=C(C=C2)OC(F)(F)F)F)NC(=O)C3=NC=C(C=C3)C(=O)O)FInChIKey: QEBYISWYMFIXOZ-INIZCTEOSA-NInChI: InChI=1S/C20H12F5N3O4/c21-12-2-1-7-26-17(12)16(10-4-6-15(13(22)8-10)32-20(23,24)25)28-18(29)14-5-3-11(9-27-14)19(30)31/h1-9,16H,(H,28,29)(H,30,31)/t16-/m0/s1
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CapsazepineCAS号 : 138977-28-3分子式: C19H21ClN2O2S 分子量: 376.9IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamideSMILES: C1CC2=CC(=C(C=C2CN(C1)C(=S)NCCC3=CC=C(C=C3)Cl)O)OInChIKey: DRCMAZOSEIMCHM-UHFFFAOYSA-NInChI: InChI=1S/C19H21ClN2O2S/c20-16-5-3-13(4-6-16)7-8-21-19(25)22-9-1-2-14-10-17(23)18(24)11-15(14)12-22/h3-6,10-11,23-24H,1-2,7-9,12H2,(H,21,25)
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(S)-(+)-2-(6-甲氧基-2-萘基)丙酸CAS号 : 22204-53-1分子式: C14H14O3 分子量: 230.26IUPAC Name: (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acidSMILES: CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OInChIKey: CMWTZPSULFXXJA-VIFPVBQESA-NInChI: InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1
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WS 12CAS号 : 68489-09-8 Compound CID : 11266244分子式: C18H27NO2 分子量: 289.42IUPAC Name: (1R,2S,5R)-N-(4-methoxyphenyl)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamideSMILES: CC1CCC(C(C1)C(=O)NC2=CC=C(C=C2)OC)C(C)CInChIKey: HNSGVPAAXJJOPQ-XOKHGSTOSA-NInChI: InChI=1S/C18H27NO2/c1-12(2)16-10-5-13(3)11-17(16)18(20)19-14-6-8-15(21-4)9-7-14/h6-9,12-13,16-17H,5,10-11H2,1-4H3,(H,19,20)/t13-,16+,17-/m1/s1