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。
-
Cc1c(NC(=O)c2nc3c(n2C)CCN(C2CCOCC2)C3)cccc1-c1cccc(NC(=O)c2nc3c(n2C)CCN(CC2CCC(C(=O)O)CC2)C3)c1Cl -
2-methyl-6-(((1s,4s)-4-(3-(1- methyl-1H-pyrazol-4-yl)-6- ((methyl-d3)amino)-1H- pyrazolo[4,3-c]pyridin-1- yl)cyclohexyl)oxy)pyridazin- 3(2H)-one PubChem CID 138682740
CNc1cc2c(cn1)c(-c1cnn(C)c1)nn2C1CCC(Oc2ccc(=O)n(C)n2)CC1 -
8-chloro-1-(4,4-difluoro-1-methylpyrrolidin-3-yl)- 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-imidazo [4,5-c]quinoline, ENT 1 PubChem CID 142423792
Cc1cc(Cc2nc3cnc4ccc(Cl)cc4c3n2C2CN(C)CC2(F)F)no1 -
5-[4-amino-5- (trifluoromethyl) pyrrolo[2 1- f][1,2,4]triazin-7- yl]-N-[(3R,4S)-4- fluoro-1-[1-(1,3- thiazol-5- yl)ethyl]pyrrolidin- 3-yl]-2- methoxypyridine-3- carboxamide PubChem CID 155251899
COc1ncc(-c2cc(C(F)(F)F)c3c(N)ncnn23)cc1C(=O)N[C@@H]1CN(C(C)c2cncs2)C[C@@H]1F -
5-[4-amino-5- (trifluoromethyl) pyrrolo[2 1- f][1,2,4]triazin-7- yl]-N-[(3R,4S)-4- fluoro-1-[1-(2- fluorophenyl)ethyl] pyrrolidin-3-yl]-2- methoxypyridine-3- carboxamide PubChem CID 155252977
COc1ncc(-c2cc(C(F)(F)F)c3c(N)ncnn23)cc1C(=O)N[C@@H]1CN(C(C)c2ccccc2F)C[C@@H]1F -
Single Diastereomer 1 of Cis-2-((6-(4-((((R)-1-(2-chlorophenyl) ethoxy)carbonyl)amino)-3-methylisoxazol-5-yl)-2-methylpyridin-3-yl)carbamoyl) cyclohexane-1-carboxylic acid PubChem CID 169756997
Cc1nc(-c2onc(C)c2NC(=O)O[C@H](C)c2ccccc2Cl)ccc1NC(=O)C1CCCCC1C(=O)O -
O=c1[nH]c2ccc(C3=NO[C@@H](C[C@H]4O[C@H](CO)[C@H](O)[C@H](n5cc(-c6cc(F)c(F)c(F)c6)nn5)[C@H]4O)C3)cc2o1 -
1-(2-(4-(9- benzyl-6-(1- methylcyclo- propoxy)- 9H-purin-8- yl)-3- chlorophenoxy) ethyl)-3- methylpiperazin- 2-one (Isomer 2) PubChem CID 171791335
CC1NCCN(CCOc2ccc(-c3nc4c(OC5(C)CC5)ncnc4n3Cc3ccccc3)c(Cl)c2)C1=O -
1-(3-Chloro-2-methylindazol-5-yl)-2- (4-cyano-3-fluorophenyl)-N-[(3S)-1- methylpyrrolidin-3-yl]imidazole-4- carboxamide PubChem CID 135326440
CN1CC[C@H](NC(=O)c2cn(-c3ccc4nn(C)c(Cl)c4c3)c(-c3ccc(C#N)c(F)c3)n2)C1 -
(2S)-2-amino-3-(4-(2- amino-6-((R)-1-(4- chloro-2-(5,6-dihydro- 2H-pyran-3-yl)phenyl)- 2,2,2- trifluoroethoxy)pyrimidine- 4-yl)cyclohex-3- ene-1-yl)propionic acid hydrochloride PubChem CID 137531859
Nc1nc(O[C@H](c2ccc(Cl)cc2C2=CCCOC2)C(F)(F)F)cc(C2=CCC(C[C@H](N)C(=O)O)CC2)n1 -
5H-PYRIDO(3,2-B)INDOLE-7-METHANOL, 3-(1,4-DIMETHYL-1H-1,2,3-TRIAZOL-5-YL)-.ALPHA.,.ALPHA.-DIMETHYL-5-((S)-PHENYL(TETRAHYDRO-2H-PYRAN-4-YL)METHYL)- CAS 1800340-40-2 PubChem CID 118196485
Cc1nnn(C)c1-c1cnc2c3ccc(C(C)(C)O)cc3n([C@H](c3ccccc3)C3CCOCC3)c2c1 -
2-Azabicyclo[3.1.0]hexane-2,3-dicarboxamide, N2-[1-(aminocarbonyl)-5-(cyanomethoxy)-1H-indol-3-yl]-N3-[(3-chloro-2-fluorophenyl)methyl]-, (1R,3S,5R)- CAS 1386452-03-4 PubChem CID 57412074
N#CCOc1ccc2c(c1)c(NC(=O)N1[C@@H]3C[C@@H]3C[C@H]1C(=O)NCc1cccc(Cl)c1F)cn2C(N)=O -
5-[4-amino-5- (trifluoromethyl)pyrrolo [2,1-f][1,2,4]triazin- 7-yl]-N-[(3R,4S)-4- fluoro-1-[(2- nitrophenyl) methanesulfonyl] pyrrolidin-3-yl]-2- methoxypyridine-3- carboxamide PubChem CID 155252883
COc1ncc(-c2cc(C(F)(F)F)c3c(N)ncnn23)cc1C(=O)N[C@@H]1CN(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C[C@@H]1F -
3-(3-(((R)-4-ethyl-1,1-dioxido-3,4-dihydro-2H-pyrido[2,3-b][1,4,5]oxathiazepin-2-yl)methyl)-4-methylphenyl)-3-(1-ethyl-4-methyl-1H-benzo[d][1,2,3]triazol-5-yl)propanoic acid PubChem CID 118169924
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3ccc4c(nnn4CC)c3C)ccc2C)S(=O)(=O)c2cccnc2O1 -
3-{3-[(Cyclopentyl{4-[5-(trifluoromethyl)pyridin-3-yl]phenyl}acetyl)amino]-2-methylphenyl}-2-methylpropanoic acid, Stereoisomer 1 PubChem CID 121417271
Cc1c(CC(C)C(=O)O)cccc1NC(=O)C(c1ccc(-c2cncc(C(F)(F)F)c2)cc1)C1CCCC1 -
N-[3-(difluoromethyl)- 1-methyl-1H-pyrazol- 4-yl]-5-[(3R or S, 4R or S-4-fluoropiperidin-3- yl)amino]pyrazolo[1,5- a]pyrimidine-3- carboxamide PubChem CID 122516528
Cn1cc(NC(=O)c2cnn3ccc(NC4CNCCC4F)nc23)c(C(F)F)n1 -
(3S)-3-[[5-[3-morpholin-4-yl-1-[6-(trifluoromethyl)pyridin-3-yl]pyrazol-4-yl]-1,3,4-oxadiazol-2-yl]amino]-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one PubChem CID 134461543
O=C1Nc2ccccc2C(c2ccccc2)=N[C@@H]1Nc1nnc(-c2cn(-c3ccc(C(F)(F)F)nc3)nc2N2CCOCC2)o1 -
(rac)-4-chloro-3-ethyl-2-methyl-7-[3-(naphthalen-1-yloxy)propyl]-2,10,11,12,13,15-hexahydropyrazolo[4',3':9,10][1,6]oxazacycloundecino[8,7,6-hi]indole-8-carboxylic Acid PubChem CID 142591254
CCc1c2c(nn1C)COCCCCn1c(C(=O)O)c(CCCOc3cccc4ccccc34)c3ccc(Cl)c-2c31 -
(R)-5-(*S)-(6-(Cyclopentyloxy)-4-methylpyridin-3-yl)-4-oxo-N- (piperidin-3-yl)-4,5-dihydro-3H-1-thia-3,5,8-triazaacenaphthylene-2- carboxamide; PubChem CID 155921512
Cc1cc(OC2CCCC2)ncc1N1C(=O)NC2=C(C(=O)N[C@@H]3CCCNC3)SC3NCCC1C23 -
C=C(C)[C@@H]1CC[C@]2(NC(CN)C(F)(F)F)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(C(=O)O)CC6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12