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Ligand

NameCHEMBL87455
Molecular formulaC32H38N4O
IUPAC name1-[6-[2-[3-methyl-5-(4-phenylphenyl)-1,2,4-triazol-4-yl]phenoxy]hexyl]piperidine
Molecular weight494.683
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP7.1
SynonymsBDBM50114039
1-{6-[2-(3-Biphenyl-4-yl-5-methyl-[1,2,4]triazol-4-yl)-phenoxy]-hexyl}-piperidine
Inchi KeyBWRRQRJOQYKKBG-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H38N4O/c1-26-33-34-32(29-20-18-28(19-21-29)27-14-6-4-7-15-27)36(26)30-16-8-9-17-31(30)37-25-13-3-2-10-22-35-23-11-5-12-24-35/h4,6-9,14-21H,2-3,5,10-13,22-25H2,1H3
PubChem CID10206901
ChEMBLCHEMBL87455
IUPHARN/A
BindingDB50114039
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
34678Vasopressin V1a receptorP37288AVPR1AHomo sapiens (Human)418
34677Vasopressin V2 receptorP30518AVPR2Homo sapiens (Human)371

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