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Ligand

NameCHEMBL315622
Molecular formulaC25H18Cl2N2O4
IUPAC name4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2-[(3-chlorophenyl)methyl]-5-phenylpyrazole-3-carboxylic acid
Molecular weight481.329
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP6.3
Synonyms4-(6-Chloro-benzo[1,3]dioxol-5-ylmethyl)-2-(3-chloro-benzyl)-5-phenyl-2H-pyrazole-3-carboxylic acid
BDBM50093998
Inchi KeyDOMPWTSDHIQDOH-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H18Cl2N2O4/c26-18-8-4-5-15(9-18)13-29-24(25(30)31)19(23(28-29)16-6-2-1-3-7-16)10-17-11-21-22(12-20(17)27)33-14-32-21/h1-9,11-12H,10,13-14H2,(H,30,31)
PubChem CID44320192
ChEMBLCHEMBL315622
IUPHARN/A
BindingDB50093998
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
65113Endothelin receptor type BP21451EdnrbRattus norvegicus (Rat)442
65112Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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