小分子和化合物库
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SB202190 (FHPI)CAS号 : 152121-30-7(DMSO)分子式: C20H14N3OF 分子量: 331.34SMILES: OC1=CC=C(C=C1)C2=NC(=C([NH]2)C3=CC=NC=C3)C4=CC=C(F)C=C4
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SB 203580(DMSO溶液)CAS号 : 152121-47-6(DMSO)分子式: C21H16FN3OS 分子量: 377.43SMILES: C[S](=O)C1=CC=C(C=C1)C2=NC(=C([NH]2)C3=CC=NC=C3)C4=CC=C(F)C=C4
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GRA Ex-25CAS号 : 307983-31-9 Compound CID : 16100296分子式: C29H36F3N3O5 分子量: 563.61IUPAC Name: 3-[[4-[[(4-tert-butylcyclohexyl)-[[4-(trifluoromethoxy)phenyl]carbamoyl]amino]methyl]benzoyl]amino]propanoic acidSMILES: CC(C)(C)C1CCC(CC1)N(CC2=CC=C(C=C2)C(=O)NCCC(=O)O)C(=O)NC3=CC=C(C=C3)OC(F)(F)FInChIKey: BZXMLCVDKDXRQY-UHFFFAOYSA-NInChI: InChI=1S/C29H36F3N3O5/c1-28(2,3)21-8-12-23(13-9-21)35(27(39)34-22-10-14-24(15-11-22)40-29(30,31)32)18-19-4-6-20(7-5-19)26(38)33-17-16-25(36)37/h4-7,10-11,14-15,21,23H,8-9,12-13,16-18H2,1-3H3,(H,33,38)(H,34,39)(H,36,37)
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AdomeglivantCAS号 : 1488363-78-5 Compound CID : 91933867分子式: C32H36F3NO4 分子量: 555.63IUPAC Name: 3-[[4-[(1S)-1-[4-(4-tert-butylphenyl)-3,5-dimethylphenoxy]-4,4,4-trifluorobutyl]benzoyl]amino]propanoic acidSMILES: CC1=CC(=CC(=C1C2=CC=C(C=C2)C(C)(C)C)C)OC(CCC(F)(F)F)C3=CC=C(C=C3)C(=O)NCCC(=O)OInChIKey: FASLTMSUPQDLIB-MHZLTWQESA-NInChI: InChI=1S/C32H36F3NO4/c1-20-18-26(19-21(2)29(20)23-10-12-25(13-11-23)31(3,4)5)40-27(14-16-32(33,34)35)22-6-8-24(9-7-22)30(39)36-17-15-28(37)38/h6-13,18-19,27H,14-17H2,1-5H3,(H,36,39)(H,37,38)/t27-/m0/s1
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PF-06291874CAS号 : 1393124-08-7 Compound CID : 60151939分子式: C26H28F3N3O4 分子量: 503.51IUPAC Name: 3-[[4-[(1S)-1-[3,5-dimethyl-4-[4-(trifluoromethyl)pyrazol-1-yl]phenoxy]butyl]benzoyl]amino]propanoic acidSMILES: CCCC(C1=CC=C(C=C1)C(=O)NCCC(=O)O)OC2=CC(=C(C(=C2)C)N3C=C(C=N3)C(F)(F)F)CInChIKey: IBDYYOQKQCCSDP-QFIPXVFZSA-NInChI: InChI=1S/C26H28F3N3O4/c1-4-5-22(18-6-8-19(9-7-18)25(35)30-11-10-23(33)34)36-21-12-16(2)24(17(3)13-21)32-15-20(14-31-32)26(27,28)29/h6-9,12-15,22H,4-5,10-11H2,1-3H3,(H,30,35)(H,33,34)/t22-/m0/s1
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PF-06291874CAS号 : 1393124-08-7(DMSO)分子式: C26H28F3N3O4 分子量: 503.51SMILES: CCCC(C1=CC=C(C=C1)C(=O)NCCC(=O)O)OC2=CC(=C(C(=C2)C)N3C=C(C=N3)C(F)(F)F)C
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4-[2-(2-bromophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]PyridineCAS号 : 384820-17-1 Compound CID : 9886904分子式: C20H13BrFN3 分子量: 394.2IUPAC Name: 4-[2-(2-bromophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridineSMILES: C1=CC=C(C(=C1)C2=NC(=C(N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)BrInChIKey: COVWDRBCMJOSQM-UHFFFAOYSA-NInChI: InChI=1S/C20H13BrFN3/c21-17-4-2-1-3-16(17)20-24-18(13-5-7-15(22)8-6-13)19(25-20)14-9-11-23-12-10-14/h1-12H,(H,24,25)
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L-精氨酸分子式: C6H14N4O2 分子量: 174.20 g/molIUPAC Name: (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acidSMILES: C(CC(C(=O)O)N)CN=C(N)NInChIKey: ODKSFYDXXFIFQN-BYPYZUCNSA-NInChI: InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1
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