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Ligand

NameCHEMBL220001
Molecular formulaC13H9F3O4
IUPAC name5-methyl-4-oxo-5-[3-(trifluoromethyl)phenyl]furan-2-carboxylic acid
Molecular weight286.206
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.6
SynonymsBDBM50208141
SCHEMBL3093540
5-methyl-4-oxo-5-(3-trifluoromethyl-phenyl)-4,5-dihydro-furan-2-carboxylic acid
Inchi KeyGIOPESNBNCSBLX-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H9F3O4/c1-12(10(17)6-9(20-12)11(18)19)7-3-2-4-8(5-7)13(14,15)16/h2-6H,1H3,(H,18,19)
PubChem CID11219885
ChEMBLCHEMBL220001
IUPHARN/A
BindingDB50208141
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
97408Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363
97409Hydroxycarboxylic acid receptor 3P49019HCAR3Homo sapiens (Human)387

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