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Ligand

NameCID 135971436
Molecular formulaC14H15ClN2O2S
IUPAC name(2S)-2-(4-chlorophenyl)-3-methyl-N-(4-oxo-1,3-thiazolidin-2-ylidene)butanamide
Molecular weight310.796
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.7
SynonymsN/A
Inchi KeyCKPQCSHEGWVPOJ-LBPRGKRZSA-N
Inchi IDInChI=1S/C14H15ClN2O2S/c1-8(2)12(9-3-5-10(15)6-4-9)13(19)17-14-16-11(18)7-20-14/h3-6,8,12H,7H2,1-2H3,(H,16,17,18,19)/t12-/m0/s1
PubChem CID135971436
ChEMBLCHEMBL593121
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
44313Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330

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