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Ligand

NameBDBM50306400
Molecular formulaC16H13NO2S2
IUPAC name4-hydroxy-5-[(4-phenylsulfanylphenyl)methyl]-3H-1,3-thiazol-2-one
Molecular weight315.405
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.1
Synonyms5-(4-(phenylthio)benzyl)thiazolidine-2,4-dione
Inchi KeyBTNJCGUXZRZBSK-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H13NO2S2/c18-15-14(21-16(19)17-15)10-11-6-8-13(9-7-11)20-12-4-2-1-3-5-12/h1-9,18H,10H2,(H,17,19)
PubChem CID91934051
ChEMBLN/A
IUPHARN/A
BindingDB50306400
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
32479Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300

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