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Ligand

NameCHEMBL609861
Molecular formulaC15H14ClF3N2OS
IUPAC name(2S)-2-(4-chlorophenyl)-3-methyl-N-[5-(trifluoromethyl)-1,3-thiazol-2-yl]butanamide
Molecular weight362.795
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.0
SynonymsBDBM50305982
(S)-2-(4-chlorophenyl)-3-methyl-N-(5-(trifluoromethyl)thiazol-2-yl)butanamide
Inchi KeyHFEMZAFKQONWLL-LBPRGKRZSA-N
Inchi IDInChI=1S/C15H14ClF3N2OS/c1-8(2)12(9-3-5-10(16)6-4-9)13(22)21-14-20-7-11(23-14)15(17,18)19/h3-8,12H,1-2H3,(H,20,21,22)/t12-/m0/s1
PubChem CID46226254
ChEMBLCHEMBL609861
IUPHARN/A
BindingDB50305982
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
113375Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330

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