Compound Search
化合物数据库
基于 PubChem CID 索引，支持名称 / 同义词 / CAS / SMILES 检索。
-
N-[4-(3-anilino-5-methyl-4-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridin-2-yl)pyridin-2-yl]-2-(4-fluorophenyl)-3-hydroxypropanamide (Stereoisomer 1) PubChem CID 154674501
CN1CCc2[nH]c(-c3ccnc(NC(=O)C(CO)c4ccc(F)cc4)c3)c(Nc3ccccc3)c2C1=O -
[(1S)-2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)-1-(3,4-dimethoxyphenyl)ethyl]5-[[[2-[[(3S)-1-methylpyrrolidin-3-yl]methoxy]-2-oxo-1-phenyl-ethyl]amino]methyl]thiophene-2-carboxylate PubChem CID 124090516
COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC[C@H]3CCN(C)C3)c3ccccc3)s2)cc1OC -
[(1S)-2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)-1-(3,4-dimethoxyphenyl)ethyl]5-[[[2-[[(3R)-1-methyl-3-piperidyl]methoxy]-2-oxo-1-phenyl-ethyl]amino]-methyl]thiophene-2-carboxylate PubChem CID 124097522
COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC[C@@H]3CCCN(C)C3)c3ccccc3)s2)cc1OC -
[2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)-1-(3-ethoxy-4-methoxy-phenyl)ethyl]5-[[[2-[(1-methyl-4-piperidyl)methoxy]-2-oxo-1-phenyl-ethyl]amino]methyl]thiophene-2-carboxylate PubChem CID 124107916
CCOc1cc(C(Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OCC3CCN(C)CC3)c3ccccc3)s2)ccc1OC -
[1-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)ethyl]5-[[[2-[(1-methyl-4-piperidyl)methoxy]-2-oxo-1-phenyl-ethyl]amino]methyl]thiophene-2-carboxylate PubChem CID 124107929
COc1ccc(C(Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OCC3CCN(C)CC3)c3ccccc3)s2)cc1OCC1CC1 -
[(1S)-2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)-1-(3,4-dimethoxyphenyl)ethyl]5-[[[2-[(4-fluoro-1-methyl-4-piperidyl)methoxy]-2-oxo-1-phenyl-ethyl]amino]methyl]thiophene-2-carboxylate PubChem CID 138403939
COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OCC3(F)CCN(C)CC3)c3ccccc3)s2)cc1OC -
CN1CCC(COC(=O)C(NCc2ccc(C(=O)O[C@@H](Cc3c(Cl)c[n+]([O-])cc3Cl)c3ccc(OC(F)F)c(OCC4CC4)c3)s2)c2ccccc2)CC1 -
[(1S)-2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)-1-(3,4-dimethoxyphenyl)ethyl]5-[[[2-[[(3R)-1-methylpyrrolidin-3-yl]methoxy]-2-oxo-1-phenyl-ethyl]amino]-methyl]thiophene-2-carboxylate PubChem CID 138403945
COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC[C@@H]3CCN(C)C3)c3ccccc3)s2)cc1OC -
[(1S)-2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)-1-(3,4-dimethoxyphenyl)ethyl]5-[[[2-[(1-methyl-4-piperidyl)methoxy]-2-oxo-1-phenyl-ethyl]amino]methyl]thiophene-3-carboxylate PubChem CID 138403958
COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2csc(CNC(C(=O)OCC3CCN(C)CC3)c3ccccc3)c2)cc1OC -
COCCOc1cc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OCC3CCN(C)CC3)c3ccccc3)s2)ccc1OC(F)F -
[(1S)-2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)-1-(3,4-dimethoxyphenyl)ethyl]5-[[[1-(3-methoxyphenyl)-2-[(1-methyl-4-piperidyl)methoxy]-2-oxo-ethyl]amino]methyl]thiophene-2-carboxylate PubChem CID 138403970
COc1cccc(C(NCc2ccc(C(=O)O[C@@H](Cc3c(Cl)c[n+]([O-])cc3Cl)c3ccc(OC)c(OC)c3)s2)C(=O)OCC2CCN(C)CC2)c1 -
(1r,3R)-N-((1R,5S,8s)-3-(5-(6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-(isopropylamino)pyridin-3-yl)-1,3,4-thiadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-yl)-3-hydroxy-3-methylcyclobutane-1-carboxamide PubChem CID 146441318
CC(C)Nc1cc(-c2ccc3cc(C#N)cnn23)ncc1-c1nnc(N2C[C@H]3CC[C@@H](C2)C3NC(=O)C2CC(C)(O)C2)s1 -
1-{(2S)-6-[5-(difluoromethyl)-1-methyl-1H-1,2,4-triazol-3-yl]-7-methyl-3,4-dihydro-1H-spiro[1 ,8-naphthyridine-2,3''-pyrrolidin]-1''-yl}-2-(6-methoxy-2-methylpyrimidin-4-yl)propan-1-one,DIAST-1 PubChem CID 166585544
COc1cc([C@@H](C)C(=O)N2CC[C@@]3(CCc4cc(-c5nc(C(F)F)n(C)n5)c(C)nc4N3)C2)nc(C)n1 -
B4-1-1-1 rel-2-((3R,4R)-4-(((6- (cyclopropyl(4- (trifluoromethyl)benzyl)amino)-5- fluoropyrimidin-4- yl)amino)methyl)-3-hydroxy-3- methylpiperidin-1-yl)acetamide 1st eluting isomer PubChem CID 156511687
CC1(O)CN(CC(N)=O)CC[C@H]1CNc1ncnc(N(Cc2ccc(C(F)(F)F)cc2)C2CC2)c1F -
(2R)-2-(5-chloro-2-methoxypyridin-4-yl)-1-{7-methyl-6-[1-methyl-5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]-3,4-dihydro-1H-spiro[1,8-naphthyridine-2,3''-pyrrolidin]-1''-yl}propan-1-one, DIAST-1 PubChem CID 166585283
COc1cc([C@@H](C)C(=O)N2CC[C@@]3(CCc4cc(-c5nc(C(F)(F)F)n(C)n5)c(C)nc4N3)C2)c(Cl)cn1 -
(2R)-2-(5-fluoro-2-methoxypyridin-4-yl)-1-{7-methyl-6-[1-methyl-5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]-3,4-dihydro-1H-spiro[1,8-naphthyridine-2,3''-pyrrolidin]-1''-yl}propan-1 -one, DIAST-1 PubChem CID 166585460
COc1cc([C@@H](C)C(=O)N2CC[C@@]3(CCc4cc(-c5nc(C(F)(F)F)n(C)n5)c(C)nc4N3)C2)c(F)cn1 -
6-(2-hydroxy- 2- methylpropoxy)- 4-(6-(6- ((1r,3r)-3- methoxycyclo- butane-1- carbonyl)-3,6- diazabicyclo[3. 1.1]heptan-3- yl)pyridin-3- yl)pyrazolo[1,5- a]pyridine-3- carbonitrile PubChem CID 134435851
COC1CC(C(=O)N2C3CC2CN(c2ccc(-c4cc(OCC(C)(C)O)cn5ncc(C#N)c45)cn2)C3)C1 -
(3[R or S],4[S or R], 5''S,7a''R)-3-fluoro-1-(3- fluoropyrazolo[1,5-a] pyrimidin-7-yl)-5''- phenyltetrahydro-3''H- spiro[piperidine-4,2''- pyrrolo[2,1-b]oxazol]-3''- one, TFA salt PubChem CID 168244887
O=C1N2[C@@H](CC[C@H]2c2ccccc2)OC12CCN(c1ccnc3c(F)cnn13)CC2F -
8-(6-((2-(3- azabicyclo[3.1.0]hexan-3- yl)ethoxy)methyl)pyridin-3- yl)-1-(trans-3- methoxycyclobutyl)-3- methyl-1H-imidazo[4,5- c]cinnolin-2(3H)-one PubChem CID 170648172
COC1CC(n2c(=O)n(C)c3nnc4ccc(-c5ccc(COCCN6CC7CC7C6)nc5)cc4c32)C1 -
4-[[(2~{R})-1-[4-(3-chlorophenyl)phenyl]-4-oxidanyl-4-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid PubChem CID 59607741
O=C(O)CCC(=O)N[C@@H](CC(=O)O)Cc1ccc(-c2cccc(Cl)c2)cc1