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Ligand

NameCHEMBL571763
Molecular formulaC39H42N4O4
IUPAC nameethyl 2-methyl-3-[4-[2-[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]ethoxy]phenyl]-2-phenoxypropanoate
Molecular weight630.789
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP8.2
SynonymsEthyl 3-(4-(2-(1,7''-Dimethyl-2''-propyl-1H,3''H-2,5''-bibenzo-[d]imidazol-3''-yl)ethoxy)-phenyl)-2-methyl-2-phenoxypropanoate
BDBM50303979
Inchi KeyHMIBJCMIYOKVEY-UHFFFAOYSA-N
Inchi IDInChI=1S/C39H42N4O4/c1-6-13-35-41-36-27(3)24-29(37-40-32-16-11-12-17-33(32)42(37)5)25-34(36)43(35)22-23-46-30-20-18-28(19-21-30)26-39(4,38(44)45-7-2)47-31-14-9-8-10-15-31/h8-12,14-21,24-25H,6-7,13,22-23,26H2,1-5H3
PubChem CID45488163
ChEMBLCHEMBL571763
IUPHARN/A
BindingDB50303979
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
118647Type-1A angiotensin II receptorP25095Agtr1Rattus norvegicus (Rat)359

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