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Ligand

NameCID 46231597
Molecular formulaC19H16N2O3S
IUPAC name4-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenoxy]-2,6-dimethylbenzonitrile
Molecular weight352.408
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.0
SynonymsN/A
Inchi KeyAFNYQXYKHONVQH-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H16N2O3S/c1-11-7-15(8-12(2)16(11)10-20)24-14-5-3-13(4-6-14)9-17-18(22)21-19(23)25-17/h3-8,17H,9H2,1-2H3,(H,21,22,23)
PubChem CID46231597
ChEMBLCHEMBL596667
IUPHARN/A
BindingDBN/A
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
4329Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300

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