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Ligand

NameCHEMBL26474
Molecular formulaC26H21ClN2O5
IUPAC name4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2-[(3-methoxyphenyl)methyl]-5-phenylpyrazole-3-carboxylic acid
Molecular weight476.913
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.7
Synonyms1-(3-Methoxybenzyl)-3-phenyl-4-(6-chloro-1,3-benzodioxole-5-ylmethyl)-1H-pyrazole-5-carboxylic acid
BDBM50089716
4-(6-Chloro-benzo[1,3]dioxol-5-ylmethyl)-2-(3-methoxy-benzyl)-5-phenyl-2H-pyrazole-3-carboxylic acid
Inchi KeyFGOULBWWTIMGSP-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H21ClN2O5/c1-32-19-9-5-6-16(10-19)14-29-25(26(30)31)20(24(28-29)17-7-3-2-4-8-17)11-18-12-22-23(13-21(18)27)34-15-33-22/h2-10,12-13H,11,14-15H2,1H3,(H,30,31)
PubChem CID10050696
ChEMBLCHEMBL26474
IUPHARN/A
BindingDB50089716
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
77958Endothelin receptor type BP21451EdnrbRattus norvegicus (Rat)442
77959Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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