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Ligand

NameCHEMBL611339
Molecular formulaC14H14Cl2N2OS
IUPAC name(2S)-2-(4-chlorophenyl)-N-(5-chloro-1,3-thiazol-2-yl)-3-methylbutanamide
Molecular weight329.239
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.0
Synonyms(S)-2-(4-chlorophenyl)-N-(5-chlorothiazol-2-yl)-3-methylbutanamide
BDBM50305981
Inchi KeyCPDXIHHGJDEMTJ-LBPRGKRZSA-N
Inchi IDInChI=1S/C14H14Cl2N2OS/c1-8(2)12(9-3-5-10(15)6-4-9)13(19)18-14-17-7-11(16)20-14/h3-8,12H,1-2H3,(H,17,18,19)/t12-/m0/s1
PubChem CID46226253
ChEMBLCHEMBL611339
IUPHARN/A
BindingDB50305981
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
47256Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330

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