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Ligand

NameCHEMBL523266
Molecular formulaC30H32N6O2
IUPAC name[1-(1-benzylbenzimidazole-2-carbonyl)piperidin-4-yl]-(4-pyridin-4-ylpiperazin-1-yl)methanone
Molecular weight508.626
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.3
SynonymsSCHEMBL14262575
[1-(1-Benzyl-1H-benzoimidazole-2-carbonyl)-piperidin-4-yl]-(4-pyridin-4-yl-piperazin-1-yl)-methanone
BDBM50264447
Inchi KeyJTXJODQXRHMMBE-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H32N6O2/c37-29(35-20-18-33(19-21-35)25-10-14-31-15-11-25)24-12-16-34(17-13-24)30(38)28-32-26-8-4-5-9-27(26)36(28)22-23-6-2-1-3-7-23/h1-11,14-15,24H,12-13,16-22H2
PubChem CID44579866
ChEMBLCHEMBL523266
IUPHARN/A
BindingDB50264447
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
159861B1 bradykinin receptorQ3BCU0BDKRB1Macaca fascicularis (Crab-eating macaque)352

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