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Ligand

NameCHEMBL3911962
Molecular formulaC31H29NO4
IUPAC name4-[[[4-(2,6-dimethylphenoxy)benzoyl]-(2-phenylethyl)amino]methyl]benzoic acid
Molecular weight479.576
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.6
SynonymsBDBM251711
SCHEMBL16506666
US9464060, 47
ZINC584598461
Inchi KeyXTKOCFGCADABCN-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H29NO4/c1-22-7-6-8-23(2)29(22)36-28-17-15-26(16-18-28)30(33)32(20-19-24-9-4-3-5-10-24)21-25-11-13-27(14-12-25)31(34)35/h3-18H,19-21H2,1-2H3,(H,34,35)
PubChem CID117903069
ChEMBLCHEMBL3911962
IUPHARN/A
BindingDB251711
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
546770Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
546769Lysophosphatidic acid receptor 5Q9H1C0LPAR5Homo sapiens (Human)372

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