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Inhibitor Report for: CHEMBL3233609-S0K-3WKD

Name Class
CHEMBL3233609-S0K-3WKDTypeCarboxamide
Sulfur Compound
Morpholine
Other_Name (5)
Chemical_NomenclatureN-(2-morpholin-4-ylphenyl)thiophene-3-carboxamide
FormulaC15H16N2O2S
MW288.4
PaperAmano_2014_Bioorg.Med.Chem_22_2427
Structure3WKD
Commentnot really a good inhibitor IC50: 1.71e+5 (nM) using PHOME as substrate
Gene_locushuman-EPHX2
CID2813415
FamilyEpoxide_hydrolase
InChIKeySULRJGWRXWPTDW-UHFFFAOYSA-N
CanonicalSMILESC1COCCN1C2=CC=CC=C2NC(=O)C3=CSC=C3
InChIInChI=1S/C15H16N2O2S/c18-15(12-5-10-20-11-12)16-13-3-1-2-4-14(13)17-6-8-19-9-7-17/h1-5,10-11H,6-9H2,(H,16,18)

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Mail to: Nicolas Lenfant, Thierry Hotelier, Yves Bourne, Pascale Marchot and Arnaud Chatonnet.
Please cite: Lenfant 2013 Nucleic.Acids.Res. or Marchot Chatonnet 2012 Prot.Pept Lett.
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