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Ligand

NameCHEMBL3979511
Molecular formulaC32H31NO5
IUPAC name2-[4-[[(3,4-dimethoxybenzoyl)-(3-phenylpropyl)amino]methyl]phenyl]benzoic acid
Molecular weight509.602
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP6.3
SynonymsSCHEMBL706705
BDBM50195688
Inchi KeyDDEOBBIJYKLCBQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H31NO5/c1-37-29-19-18-26(21-30(29)38-2)31(34)33(20-8-11-23-9-4-3-5-10-23)22-24-14-16-25(17-15-24)27-12-6-7-13-28(27)32(35)36/h3-7,9-10,12-19,21H,8,11,20,22H2,1-2H3,(H,35,36)
PubChem CID66774362
ChEMBLCHEMBL3979511
IUPHARN/A
BindingDB50195688
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
537396Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364

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