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Ligand

NameCHEMBL595235
Molecular formulaC13H11ClFN3OS
IUPAC name(2S)-2-(2-chloropyridin-4-yl)-2-cyclopropyl-N-(5-fluoro-1,3-thiazol-2-yl)acetamide
Molecular weight311.759
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.5
SynonymsBDBM50305935
(S)-2-(2-chloropyridin-4-yl)-2-cyclopropyl-N-(5-fluorothiazol-2-yl)acetamide
Inchi KeyACAQUQFNLKTVTP-NSHDSACASA-N
Inchi IDInChI=1S/C13H11ClFN3OS/c14-9-5-8(3-4-16-9)11(7-1-2-7)12(19)18-13-17-6-10(15)20-13/h3-7,11H,1-2H2,(H,17,18,19)/t11-/m0/s1
PubChem CID46226385
ChEMBLCHEMBL595235
IUPHARN/A
BindingDB50305935
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
1383Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330

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