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Ligand

NameCHEMBL484468
Molecular formulaC28H32N6O
IUPAC name2-[(1-benzylbenzimidazol-2-yl)methyl-ethylamino]-1-(4-pyridin-4-ylpiperazin-1-yl)ethanone
Molecular weight468.605
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.3
SynonymsBDBM50264559
2-[(1-Benzyl-1H-benzoimidazol-2-ylmethyl)-ethyl-amino]-1-(4-pyridin-4-yl-piperazin-1-yl)-ethanone
Inchi KeyZAWHVIATEKHWAO-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H32N6O/c1-2-31(22-28(35)33-18-16-32(17-19-33)24-12-14-29-15-13-24)21-27-30-25-10-6-7-11-26(25)34(27)20-23-8-4-3-5-9-23/h3-15H,2,16-22H2,1H3
PubChem CID44579926
ChEMBLCHEMBL484468
IUPHARN/A
BindingDB50264559
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
424031B1 bradykinin receptorQ3BCU0BDKRB1Macaca fascicularis (Crab-eating macaque)352

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