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Ligand

NameCHEMBL390519
Molecular formulaC28H35N3O4
IUPAC name3-[[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazole-4-carbonyl]amino]benzoic acid
Molecular weight477.605
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP5.3
Synonyms3-{[5-(adamantan-1-yloxymethyl)-2-cyclohexyl-1H-imidazole-4-carbonyl]-amino}-benzoic acid
RKPUHYCGNGSOCF-UHFFFAOYSA-N
3-{[5-(adamantan-1-yloxymethyl)-2-cyclohexyl -1H-imidazole-4-carbonyl]-amino}-benzoic acid
SCHEMBL6160887
BDBM50410544
[ Show all ]
Inchi KeyRKPUHYCGNGSOCF-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H35N3O4/c32-26(29-22-8-4-7-21(12-22)27(33)34)24-23(30-25(31-24)20-5-2-1-3-6-20)16-35-28-13-17-9-18(14-28)11-19(10-17)15-28/h4,7-8,12,17-20H,1-3,5-6,9-11,13-16H2,(H,29,32)(H,30,31)(H,33,34)
PubChem CID9832467
ChEMBLCHEMBL390519
IUPHARN/A
BindingDB50410544
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
298476Cholecystokinin receptor type AQ63931CCKARCavia porcellus (Guinea pig)430
298480Cholecystokinin receptor type AP32238CCKARHomo sapiens (Human)428
298475Gastrin/cholecystokinin type B receptorP30552CCKBRCanis lupus familiaris (Dog)453
298477Gastrin/cholecystokinin type B receptorP56481CckbrMus musculus (Mouse)453
298478Gastrin/cholecystokinin type B receptorP30553CckbrRattus norvegicus (Rat)452
298479Gastrin/cholecystokinin type B receptorP32239CCKBRHomo sapiens (Human)447

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