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Ligand

NameCHEMBL480018
Molecular formulaC26H27N3O4S
IUPAC name2-[4-[[2-butyl-5-(methylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]benzoic acid
Molecular weight477.579
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.9
SynonymsBDBM50412548
Inchi KeyCMTFLSAUVQBGSJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H27N3O4S/c1-3-4-9-25-28-23-16-20(34(32,33)27-2)14-15-24(23)29(25)17-18-10-12-19(13-11-18)21-7-5-6-8-22(21)26(30)31/h5-8,10-16,27H,3-4,9,17H2,1-2H3,(H,30,31)
PubChem CID44570215
ChEMBLCHEMBL480018
IUPHARN/A
BindingDB50412548
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
45669Type-1A angiotensin II receptorP25095Agtr1Rattus norvegicus (Rat)359

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