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Ligand

NameCHEMBL515161
Molecular formulaC31H29N5O2
IUPAC name(4-isoquinolin-3-ylpiperazin-1-yl)-[1-(3-methoxyphenyl)-2-(4-methylphenyl)imidazol-4-yl]methanone
Molecular weight503.606
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP5.6
SynonymsBDBM50262816
(4-(isoquinolin-3-yl)piperazin-1-yl)(1-(3-methoxyphenyl)-2-p-tolyl-1H-imidazol-4-yl)methanone
Inchi KeyCCFUQIBZCDKHQD-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H29N5O2/c1-22-10-12-23(13-11-22)30-33-28(21-36(30)26-8-5-9-27(19-26)38-2)31(37)35-16-14-34(15-17-35)29-18-24-6-3-4-7-25(24)20-32-29/h3-13,18-21H,14-17H2,1-2H3
PubChem CID44578423
ChEMBLCHEMBL515161
IUPHARN/A
BindingDB50262816
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
38518Cholecystokinin receptor type AP32238CCKARHomo sapiens (Human)428
38519Gastrin/cholecystokinin type B receptorP32239CCKBRHomo sapiens (Human)447

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