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Ligand

NameCHEMBL1829153
Molecular formulaC16H13ClN2O2
IUPAC name3-[4-[2-(2-chloro-6-methylpyrimidin-4-yl)ethynyl]phenyl]propanoic acid
Molecular weight300.742
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.4
SynonymsBDBM50419161
Inchi KeyBNLHRAHBMGBALX-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H13ClN2O2/c1-11-10-14(19-16(17)18-11)8-6-12-2-4-13(5-3-12)7-9-15(20)21/h2-5,10H,7,9H2,1H3,(H,20,21)
PubChem CID54757622
ChEMBLCHEMBL1829153
IUPHARN/A
BindingDB50419161
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
28214Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300

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