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Ligand

NameCHEMBL92965
Molecular formulaC27H25NO4S
IUPAC name4-(2-methylphenyl)-4-[2-pyridin-2-yl-5-(thiophen-3-ylmethoxy)phenoxy]butanoic acid
Molecular weight459.56
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.4
Synonyms4-[2-(2-Pyridyl)-5-(3-thienylmethoxy)phenoxy]-4-(2-methylphenyl)butyric acid
BDBM50065520
SCHEMBL7907773
4-[2-Pyridin-2-yl-5-(thiophen-3-ylmethoxy)-phenoxy]-4-o-tolyl-butyric acid
Inchi KeyBRFPHZRJHAJJMA-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H25NO4S/c1-19-6-2-3-7-22(19)25(11-12-27(29)30)32-26-16-21(31-17-20-13-15-33-18-20)9-10-23(26)24-8-4-5-14-28-24/h2-10,13-16,18,25H,11-12,17H2,1H3,(H,29,30)
PubChem CID10504148
ChEMBLCHEMBL92965
IUPHARN/A
BindingDB50065520
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
30944Endothelin receptor type BP21451EdnrbRattus norvegicus (Rat)442
30945Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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