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Ligand

NameCHEMBL3956413
Molecular formulaC31H28FNO4
IUPAC name4-[[[4-(2-fluorophenoxy)benzoyl]-(4-phenylbutyl)amino]methyl]benzoic acid
Molecular weight497.566
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP6.7
SynonymsZINC584598164
BDBM251685
SCHEMBL16506652
US9464060, 21
Inchi KeyBKRGCMOFALKWJU-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H28FNO4/c32-28-11-4-5-12-29(28)37-27-19-17-25(18-20-27)30(34)33(21-7-6-10-23-8-2-1-3-9-23)22-24-13-15-26(16-14-24)31(35)36/h1-5,8-9,11-20H,6-7,10,21-22H2,(H,35,36)
PubChem CID117903056
ChEMBLCHEMBL3956413
IUPHARN/A
BindingDB251685
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
536667Lysophosphatidic acid receptor 5Q9H1C0LPAR5Homo sapiens (Human)372

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