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Inhibitor Report for: ZINC10109382-S0A-3WK4

Name Class
ZINC10109382-S0A-3WK4TypeUrea derivative
Cyclopropyl
Other_NameS0A
ZINC10109382
Q27465193
Chemical_Nomenclature1-[(1R)-1-cyclopropylethyl]-3-phenylurea
FormulaC12H16N2O
MW204.27
PaperAmano_2014_Bioorg.Med.Chem_22_2427
Structure3WK4
Commentnot really a good inhibitor IC50: 7400 (nM) using PHOME as substrate
Gene_locushuman-EPHX2
CID51473388
FamilyEpoxide_hydrolase
InChIKeyVBBOGUVAPQGDSX-SECBINFHSA-N
CanonicalSMILESCC(C1CC1)NC(=O)NC2=CC=CC=C2
InChIInChI=1S/C12H16N2O/c1-9(10-7-8-10)13-12(15)14-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H2,13,14,15)/t9-/m1/s1

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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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