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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COc1cccc(N2CCNCC2)c1.Cl.Cl -
8,19-diazahexacyclo[10.10.2.02,7.09,23.013,18.020,24]tetracosa-1(23),2,4,6,8,10,12(24),13,15,17,19,21-dodecaene CAS 189-66-2 PubChem CID 188944
c1ccc2c(c1)nc1ccc3c4ccccc4nc4ccc2c1c43 -
10-[(2-aminoethyl)amino]-14-[2-(diethylamino)ethyl]-8-thia-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2,4,6,9(16),10,12-heptaen-5-ol CAS 113457-05-9 PubChem CID 366673
CCN(CC)CCn1[nH]c2c3ccc(=O)cc3sc3c(NCCN)ccc1c32 -
dihydroxy(oxo)azanium; 2-(5,6,7,8-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole CAS 71093-29-3 PubChem CID 6335865
O=[N+](O)O.c1cc2c(c(CC3=NCCN3)c1)CCCC2 -
CC(C)C[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)O -
1H-Imidazolium,1-(2-carboxyethyl)-2-(heptadecenyl)-4,5-dihydro-1-(2-hydroxyethyl)-, hydroxide,monosodium salt (9CI) CAS 71929-17-4 PubChem CID 57353101
CCCCCCCCCCCCCCCC=CC1=NCC[N+]1(CCO)CCC(=O)O.[Na].[OH-] -
4,5-dihydro-2-[(5,6,7,8-tetrahydro-1-naphthyl)methyl]-1H-imidazolium nitrate CAS 71093-29-3 PubChem CID 90475430
O=[N+]([O-])[O-].c1cc2c(c(CC3=[NH+]CCN3)c1)CCCC2 -
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(=O)O -
1,1,1-trideuterio-2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-ol CAS 203633-12-9 PubChem CID 102602333
[2H]C([2H])([2H])C(C)(O)[C@@H]1CC=C(C)CC1 -
Sodium 1- (2- carboxyethyl)- 2- (heptadecenyl)- 4, 5- dihydro- 1- (2- hydroxyethyl)- 1H- imidazolium hydroxide CAS 71929-17-4 PubChem CID 118856526
CCCCCCCCCCCCCCC/C=C/C1=[NH+]CC[N+]1(CCO)CCC(=O)O.[Na+].[OH-].[OH-] -
(cis)-6'-[(6-fluoroquinazolin-4-yl)amino]-4-hydroxy-8'-methyl-4-(trifluoromethyl)-2'H-spiro[cyclohexane-1,3'-imidazo[1,5-a]pyridine]-1',5'-dione PubChem CID 135259276
Cc1cc(Nc2ncnc3ccc(F)cc23)c(=O)n2c1C(=O)NC21CCC(O)(C(F)(F)F)CC1 -
COCC[C@@H]1[C@@H](C)C/C=C/[C@@](CN2CCN(C(C)(C)C)CC2)(OC)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc43)COc3ccc(cc32)C(=O)NS1(=O)=O -
(S)-quinuclidin-3-yl (6''-(4-(trifluoromethoxy)phenyl)-3'',4''-dihydro-1''H-spiro[cyclopropane-1,2''-naphthalen]-1''-yl)carbamate PubChem CID 156739955
O=C(NC1c2ccc(-c3ccc(OC(F)(F)F)cc3)cc2CCC12CC2)O[C@@H]1CN2CCC1CC2 -
(3R)-4-[2- cyclohexyl-8- (methoxycarbonyl)- 3H,6H,7H,8H, 9H- imidazo[4,5- h]isoquinolin- 3-yl]-3-(3,4- difluorophenyl) butanoic acid PubChem CID 164806925
COC(=O)N1CCc2ccc3c(nc(C4CCCCC4)n3C[C@@H](C(=O)O)c3ccc(F)c(F)c3)c2C1 -
(1R,2S)-2-(3-{[2-(4,4-difluoropiperidin-1-yl)-5-methoxypyrimidin-4-yl]amino}-1H-indazol-6-yl)-5'-methoxyspiro[cyclopropane-1,3'-indol]-2'(1'H)-one PubChem CID 169551714
COc1ccc2c(c1)[C@]1(C[C@H]1C1CCC3C(C1)NNC3Nc1nc(N3CCC(F)(F)CC3)ncc1OC)C(=O)N2 -
(stereospecific procedure): N-{6-[(3-cyclopropyl-1 H-pyrazol-5-yl)amino]-5-methoxy-1,2-benzoxazol-3-yl}-2,6-dimethoxy-4-[(2S)-1-methylpyrrolidin-2-yl]benzene-1-sulfonamide PubChem CID 176511488
COc1ccc(CN(c2noc3cc(Nc4cc(C5CC5)[nH]n4)c(OC)cc23)S(=O)(=O)c2c(OC)cc([C@@H]3CCCN3C(=O)OC(C)(C)C)cc2OC)cc1