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Ligand

NameCHEMBL3953068
Molecular formulaC29H33NO6
IUPAC name2-[4-[[(3,5-dimethoxy-4-methylbenzoyl)-(4-phenylbutyl)amino]methyl]phenoxy]acetic acid
Molecular weight491.584
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.4
SynonymsBDBM50195774
SCHEMBL708787
Inchi KeyBITAYMUUSWSMNW-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H33NO6/c1-21-26(34-2)17-24(18-27(21)35-3)29(33)30(16-8-7-11-22-9-5-4-6-10-22)19-23-12-14-25(15-13-23)36-20-28(31)32/h4-6,9-10,12-15,17-18H,7-8,11,16,19-20H2,1-3H3,(H,31,32)
PubChem CID66775150
ChEMBLCHEMBL3953068
IUPHARN/A
BindingDB50195774
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
536611Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364

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