Compound Search
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基于 PubChem CID 索引，支持名称 / 同义词 / CAS / SMILES 检索。
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CCC(CCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1cn(OC)c2ccccc12)C(=O)N[C@H](C(=O)N1CCCC[C@@H]1C(=O)OC)[C@@H](C)CC)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C -
1-{(S)-3-Methyl-2-[4-(morpholine-4-carbonyl)-benzoylamino]-butyryl}-piperidine-2-carboxylic acid (3,3,4,4,4-pentafluoro-1-isopropyl-2-oxo-butyl)-amide PubChem CID 11802328
CC(C)C(NC(=O)C1CCCCN1C(=O)[C@@H](NC(=O)c1ccc(C(=O)N2CCOCC2)cc1)C(C)C)C(=O)C(F)(F)C(F)(F)F -
(2R)-3-[(hydroxy{[(1R,2R,3R,4R,5S,6R)-2,3,4,6-tetrahydroxy-5-(phosphonooxy)cyclohexyl]oxy}phosphoryl)oxy]propane-1,2-diyl dioctanoate PubChem CID 16219819
CCCCCCCC(=O)OC[C@H](COP(=O)(O)O[C@H]1[C@H](O)[C@@H](OP(=O)(O)O)[C@H](O)[C@@H](O)[C@H]1O)OC(=O)CCCCCCC -
(3-chlorophenyl){4-[7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}methanone PubChem CID 16646838
COc1ccc(-n2cc(-c3ccccc3)c3c(N4CCN(C(=O)c5cccc(Cl)c5)CC4)ncnc32)cc1 -
(4-methoxyphenyl){4-[7-(3-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}methanone PubChem CID 16647003
COc1ccc(C(=O)N2CCN(c3ncnc4c3c(-c3ccccc3)cn4-c3cccc(C)c3)CC2)cc1 -
ethyl 2-(4-(7-isobutyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazin-1-yl)acetate CAS 898408-69-0 PubChem CID 16803110
CCOC(=O)CN1CCN(c2nc3c(c(=O)[nH]c(=O)n3C)n2CC(C)C)CC1 -
[4-(2-chlorobenzyl)piperazin-1-yl]{1-[(2-chloro-5-methylphenoxy)methyl]-1H-pyrazol-3-yl}methanone PubChem CID 17022251
Cc1ccc(Cl)c(OCn2ccc(C(=O)N3CCN(Cc4ccccc4Cl)CC3)n2)c1 -
{1-[(2-chloro-5-methylphenoxy)methyl]-1H-pyrazol-3-yl}[4-(2-methylbenzyl)piperazin-1-yl]methanone PubChem CID 17022252
Cc1ccc(Cl)c(OCn2ccc(C(=O)N3CCN(Cc4ccccc4C)CC3)n2)c1 -
[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]{1-[(3-nitrophenyl)sulfonyl]piperidin-4-yl}methanone PubChem CID 17023793
O=C(C1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1)N1N=CCC1(O)C(F)(F)F -
(3S,6S,9S,15aR)-9-[(2S)-butan-2-yl]-3-(7-hydroxy-6-oxooctyl)-6-[(1-methoxy-1H-indol-3-yl)methyl]-tetradecahydro-1H-pyrido[1,2-a]1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrone PubChem CID 21670609
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cn(OC)c3ccccc23)NC(=O)[C@H](CCCCCC(=O)C(C)O)NC(=O)[C@H]2CCCCN2C1=O -
methyl (2S,3S)-2-[(2S)-3-(1-methoxy-1H-indol-3-yl)-2-[(2S)-8-oxo-2-{[(2R)-piperidin-2-yl]formamido}decanamido]propanamido]-3-methylpentanoate PubChem CID 21670612
CCC(=O)CCCCC[C@H](NC(=O)[C@H]1CCCCN1)C(=O)N[C@@H](Cc1cn(OC)c2ccccc12)C(=O)N[C@H](C(=O)OC)[C@@H](C)CC -
5-(PIPERIDIN-2-YL)-3-(THIOPHEN-2-YL)-1,2,4-OXADIAZOLE PubChem CID 43111602
c1csc(-c2noc(C3CCCCN3)n2)c1 -
(2r)-3-{[(S)-Hydroxy{[(1r,2r,3r,4r,5s,6r)-2,3,5,6-Tetrahydroxy-4-(Phosphonooxy)cyclohexyl]oxy}phosphoryl]oxy}propane-1,2-Diyl Dioctanoate PubChem CID 46174176
CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC1[C@H](O)[C@H](O)C(OP(=O)(O)O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC -
N-{3-[(3S,6S,9S,15aR)-9-benzyl-6-ethyl-1,4,7,10-tetraoxo-tetradecahydro-1H-pyrido[1,2-a]1,4,7,10-tetraazacyclododecan-3-yl]propyl}guanidine PubChem CID 46915155
CC[C@@H]1NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H]2CCCCN2C(=O)[C@H](Cc2ccccc2)NC1=O -
1-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4-piperidinecarboxylic acid PubChem CID 56686581
Cc1cccc(-c2noc(CN3CCC(C(=O)O)CC3)n2)c1 -
(2R)-2,3-bis(octanoyloxy)propyl (1R,2R,3R,4R,5S,6R)-2,3,4,6-tetrahydroxy-5-(phosphonatooxy)cyclohexyl phosphate PubChem CID 86289674
CCCCCCCC(=O)OC[C@H](COP(=O)([O-])O[C@H]1[C@H](O)[C@@H](OP(=O)([O-])[O-])[C@H](O)[C@@H](O)[C@H]1O)OC(=O)CCCCCCC -
benzyl N-[(2R)-1-[(2S)-2-{[(3S)-1-carbamimidoyl-2-hydroxypiperidin-3-yl]carbamoyl}piperidin-1-yl]-3-hydroxy-1-oxopropan-2-yl]carbamate PubChem CID 101045042
N=C(N)N1CCC[C@H](NC(=O)[C@@H]2CCCCN2C(=O)[C@@H](CO)NC(=O)OCc2ccccc2)C1O -
CN[C@@H](Cc1ccccc1)C(=O)O[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)O[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)O[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1C(=O)O[C@H](C)C(=O)O -
CC[C@H](C)[C@H](NC)C(=O)O[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)O[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)O[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1C(=O)O[C@H](C)C(=O)O -
CCCC[C@H](NC)C(=O)O[C@H](C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)O[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)O[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1C(=O)O[C@H](C)C(=O)O