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Ligand

NameCHEMBL281865
Molecular formulaC26H22N2O5
IUPAC name4-(1,3-benzodioxol-5-ylmethyl)-2-[(3-methoxyphenyl)methyl]-5-phenylpyrazole-3-carboxylic acid
Molecular weight442.471
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.1
Synonyms4-Benzo[1,3]dioxol-5-ylmethyl-2-(3-methoxy-benzyl)-5-phenyl-2H-pyrazole-3-carboxylic acid
BDBM50089721
Inchi KeyFNTQOHODKUIKDA-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H22N2O5/c1-31-20-9-5-6-18(12-20)15-28-25(26(29)30)21(24(27-28)19-7-3-2-4-8-19)13-17-10-11-22-23(14-17)33-16-32-22/h2-12,14H,13,15-16H2,1H3,(H,29,30)
PubChem CID10252787
ChEMBLCHEMBL281865
IUPHARN/A
BindingDB50089721
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
82923Endothelin receptor type BP21451EdnrbRattus norvegicus (Rat)442
82922Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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