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Ligand

NameCHEMBL87239
Molecular formulaC27H33N7O
IUPAC name5-butyl-2-(cyclohexylmethyl)-4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-3-one
Molecular weight471.609
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.6
SynonymsBDBM50044523
SCHEMBL7830702
5-Butyl-2-cyclohexylmethyl-4-[2''-(2H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-2,4-dihydro-[1,2,4]triazol-3-one
4-[[2'-(2H-Tetrazol-5-yl)-1,1'-biphenyl-4-yl]methyl]-5-butyl-2-cyclohexylmethyl-2H-1,2,4-triazol-3(4H)-one
Inchi KeyBNJBKSRGCZLHDZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H33N7O/c1-2-3-13-25-30-34(19-20-9-5-4-6-10-20)27(35)33(25)18-21-14-16-22(17-15-21)23-11-7-8-12-24(23)26-28-31-32-29-26/h7-8,11-12,14-17,20H,2-6,9-10,13,18-19H2,1H3,(H,28,29,31,32)
PubChem CID10298977
ChEMBLCHEMBL87239
IUPHARN/A
BindingDB50044523
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
28173Type-1 angiotensin II receptorP34976AGTR1Oryctolagus cuniculus (Rabbit)359

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