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。
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Sodium (2S,3R)-3-cyclopropyl-3-((R or S)-2-(2'-fluoro-5'-methoxy-[1,1'-biphenyl]-4-yl)-1,2,3,4-tetrahydroquinolin PubChem CID 155818457
COc1ccc(F)c(-c2ccc(C3CCc4ccc([C@H](C5CC5)[C@H](C)C(=O)[O-])cc4N3)cc2)c1 -
rel-2-((1R,4R,7R)-7-amino-2-azabicyclo[2.2.1]heptan-2-yl)-5-(4-chloro-2-ethyl-2H-indazol-5-yl)-3-methyl PubChem CID 146307779
CCn1cc2c(Cl)c(-c3c[nH]c4nc(N5C[C@H]6CC[C@@H]5[C@@H]6N)n(C)c(=O)c34)ccc2n1 -
N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-5-(((cis)-4-(dimethylamino)cyclohexyl)(ethyl)amino PubChem CID 131953989
CCN(c1scc(C(=O)NCC2C(=O)N=C(C)C=C2C)c1C)C1CCC(N(C)C)CC1 -
Example 962A methyl (1r,4S,7'S)-4-(3-chloroanilino)-7'-[(2R)-2-methyl-3-{[(5R,8R)-5-methyl-8-{[tri(propan PubChem CID 171918577
C[C@@H](COc1ccnc2c1[C@H](C)CC[C@H]2O)C[C@H]1Cc2cc3c(cc2C12CCC(Nc1cccc(Cl)c1)(C(=O)O)CC2)OCCO3 -
7-(1-(7-(4-cyano-3-fluorophenyl)-8-(3-hydroxy-4-methylphenyl)imidazo[1,2-c]pyrimidin-5-yl)piperidin-4 PubChem CID 177859423
Cc1ccc(-c2c(-c3ccc(C#N)c(F)c3)nc(N3CCC(CCCCCCCC(=O)NO)CC3)n3ccnc23)cc1O -
7-((4-carboxyphenyl)carbamoyl)-3-(5-chloro-2-(1H-tetrazol-1-yl)phenyl)-7-(cyclopropylmethyl)-6,7-dihydro PubChem CID 137529959
CC(C)(C)OC(=O)c1ccc(NC(=O)C2(CC3CC3)CCc3cc(-c4cc(Cl)ccc4-n4cnnn4)c[n+]([O-])c32)cc1 -
4-methyl-1-[(3-oxo- 1,4-oxazepan-7- yl)methyl]-5- [[2-[6-(2,2,2- trifluoroethyl) quinazolin-4-yl]-2,7 PubChem CID 172395747
Cc1c(CN2CCC3(CC2)CN(c2ncnc4ccc(CC(F)(F)F)cc24)C3)ccc2c1cc(C#N)n2CC1CCNC(=O)CO1 -
(S)-7-((3-((1R,5S,6R)- 3-amino-5- (difluoromethyl)-2- oxa-4- azabicyclo[4.1.0]hept- 3-en-5-yl)-4- fluorophenyl PubChem CID 90414651
N#Cc1cnc2c(c1)CCC2Nc1ccc(F)c([C@@]2(C(F)F)N=C(N)O[C@@H]3C[C@@H]32)c1 -
N-((1R,5S,8S)-3-(5-(4-(((R)-1-cyanoethyl)amino)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)pyridin-3-yl)- PubChem CID 146393492
CC(=O)NC1[C@@H]2CC[C@H]1CN(c1nnc(-c3cnc(-c4ccc5cc(C#N)cnn45)cc3N[C@H](C)C#N)s1)C2 -
(R)-N-((1R,5S,8s)-3-(5-(6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-(isopropylamino)pyridin-3-yl)-1,3,4 PubChem CID 146393501
CC(C)Nc1cc(-c2ccc3cc(C#N)cnn23)ncc1-c1nnc(N2C[C@H]3CC[C@@H](C2)C3NC(=O)[C@@H](C)O)s1 -
N-((1R,5S,8s)-3-(5-(6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-(isopropylamino)pyridin-3-yl)-1,3,4-thiadiazol PubChem CID 146393532
CC(C)Nc1cc(-c2ccc3cc(C#N)cnn23)ncc1-c1nnc(N2C[C@H]3CC[C@@H](C2)C3NC(=O)N2CCN(C)CC2)s1 -
4-acetyl-N-((1R,5S,8s)-3-(5-(6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-(isopropylamino)pyridin-3-yl)- PubChem CID 146393663
CC(=O)N1CCN(C(=O)NC2[C@@H]3CC[C@H]2CN(c2nnc(-c4cnc(-c5ccc6cc(C#N)cnn56)cc4NC(C)C)s2)C3)CC1 -
N-((1r,4r)-4-(5-(6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-(isopropylamino)pyridin-3-yl)-1,3,4-thiadiazol PubChem CID 146393676
CC(C)Nc1cc(-c2ccc3cc(C#N)cnn23)ncc1-c1nnc(C2CCC(NC(=O)OC(C)(C)C)CC2)s1 -
N-((1R,5S,8S)-3-(5-(4-(((R)-1-cyanoethyl)amino)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)pyridin-3-yl)- PubChem CID 168474913
C[C@H](C#N)Nc1cc(-c2ccc3cc(C#N)cnn23)ncc1-c1nnc(C2C[C@H]3CC[C@@H](C2)C3NC(=O)C2CC2)s1 -
Example 631A methyl (1r,2'S,4S)-4-(3-chloroanilino)-2'-{(2R)-3-[(3-chloro-1-methyl-1H-pyrrolo[3,2-b]pyridin PubChem CID 171918466
COC(=O)C1(Nc2cccc(Cl)c2)CCC2(CC1)c1ccccc1C[C@@H]2C[C@@H](C)COc1ccnc2c(Cl)cn(C)c12 -
Example 384 Preparation of 1- (3-(7-ethoxy-6- methoxy- quinazolin- 4-yloxy)phenyl)- 3-(1-phenyl-3- (trifluoromethyl PubChem CID 58267731
CCOc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(C(F)(F)F)nn4-c4ccccc4)c3)c2cc1OC -
Example 388 Preparation of 1- (5- (1,3-difluoro-2- methylpropan-2- yl) isoxazol-3-yl)-3- (3- (7-ethoxy PubChem CID 58267747
CCOc1cc2ncnc(Sc3cccc(NC(=O)Nc4cc(C(C)(CF)CF)on4)c3)c2cc1OC -
US9670208, Example 132 4-(3-(1-((5-fluoro-2-methoxypyridin-3-yl)methyl)piperidin-3-yl)-[1,2,4]triazolo PubChem CID 118216803
COc1ncc(F)cc1CN1CCCC(c2nnc3cc(-c4ccnc(NC5CCOCC5)n4)ccn23)C1 -
N-(4-(5-(6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-(oxetan-3-ylamino)pyridin-3-yl)-1,3,4-thiadiazol-2 PubChem CID 146382440
CC(=O)NC1CCC(F)(c2nnc(-c3cnc(-c4ccc5cc(C#N)cnn45)cc3NC3COC3)s2)CC1 -
7-(4-(isopropylamino)-5-(5-((1r,3r)-3-(oxetan-3-ylamino)cyclobutyl)-1,3,4-thiadiazol-2-yl)pyridin-2-yl PubChem CID 146393370
CC(C)Nc1cc(-c2ccc3cc(C#N)cnn23)ncc1-c1nnc(C2CC(NC3COC3)C2)s1