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Ligand

NameCHEMBL38176
Molecular formulaC24H18FN3O
IUPAC name3-(3-fluorophenyl)-2-[2-(1H-indol-3-yl)ethyl]quinazolin-4-one
Molecular weight383.426
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.5
SynonymsBDBM50011951
2-[2-(1H-Indol-3-yl)ethyl]-3-(3-fluorophenyl)quinazolin-4(3H)-one
3-(3-Fluoro-phenyl)-2-[2-(1H-indol-3-yl)-ethyl]-3H-quinazolin-4-one
Inchi KeyABTBCXDBGULBKM-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H18FN3O/c25-17-6-5-7-18(14-17)28-23(27-22-11-4-2-9-20(22)24(28)29)13-12-16-15-26-21-10-3-1-8-19(16)21/h1-11,14-15,26H,12-13H2
PubChem CID10452527
ChEMBLCHEMBL38176
IUPHARN/A
BindingDB50011951
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
1156Gastrin/cholecystokinin type B receptorP56481CckbrMus musculus (Mouse)453

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