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Ligand

NameCHEMBL483036
Molecular formulaC30H38N6O2
IUPAC name[(2R)-1-(1-benzylbenzimidazole-2-carbonyl)pyrrolidin-2-yl]-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]methanone
Molecular weight514.674
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.3
SynonymsBDBM50264529
(1-Benzyl-1H-benzoimidazol-2-yl)-{(R)-2-[4-(1-methyl-piperidin-4-yl)-piperazine-1-carbonyl]-pyrrolidin-1-yl}-methanone
Inchi KeyPMIBGRJDGXGXSR-HHHXNRCGSA-N
Inchi IDInChI=1S/C30H38N6O2/c1-32-16-13-24(14-17-32)33-18-20-34(21-19-33)29(37)27-12-7-15-35(27)30(38)28-31-25-10-5-6-11-26(25)36(28)22-23-8-3-2-4-9-23/h2-6,8-11,24,27H,7,12-22H2,1H3/t27-/m1/s1
PubChem CID44579913
ChEMBLCHEMBL483036
IUPHARN/A
BindingDB50264529
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
263272B1 bradykinin receptorQ3BCU0BDKRB1Macaca fascicularis (Crab-eating macaque)352

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