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Ligand

NameCHEMBL594597
Molecular formulaC14H15ClN2O2S
IUPAC name(2S)-2-(4-chlorophenyl)-4-methoxy-N-(1,3-thiazol-2-yl)butanamide
Molecular weight310.796
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.9
SynonymsBDBM50305925
(S)-2-(4-chlorophenyl)-4-methoxy-N-(thiazol-2-yl)butanamide
Inchi KeyFRVUAPNBUCXRLI-LBPRGKRZSA-N
Inchi IDInChI=1S/C14H15ClN2O2S/c1-19-8-6-12(10-2-4-11(15)5-3-10)13(18)17-14-16-7-9-20-14/h2-5,7,9,12H,6,8H2,1H3,(H,16,17,18)/t12-/m0/s1
PubChem CID46226355
ChEMBLCHEMBL594597
IUPHARN/A
BindingDB50305925
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
85780Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330

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