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Ligand

NameCHEMBL1829146
Molecular formulaC17H15NO2
IUPAC name3-[4-[2-(6-methylpyridin-2-yl)ethynyl]phenyl]propanoic acid
Molecular weight265.312
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.1
SynonymsBDBM50419173
SCHEMBL1549563
ZINC72118914
Inchi KeyAVAPGBWGSJATFN-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H15NO2/c1-13-3-2-4-16(18-13)11-9-14-5-7-15(8-6-14)10-12-17(19)20/h2-8H,10,12H2,1H3,(H,19,20)
PubChem CID54757514
ChEMBLCHEMBL1829146
IUPHARN/A
BindingDB50419173
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
15133Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300

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