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Inhibitor Report for: Fragment-077

Name Class
Fragment-077TypeFragment inhibitor of Notum
Triazol
Other_Name (9)
Chemical_Nomenclature[1-(3,4-dichlorophenyl)triazol-4-yl]methanol
FormulaC9H7Cl2N3O
CAS_number338419-11-7
MW244.07
PaperWillis_2022_J.Med.Chem_65_7212
Zhao_2022_ACS.Chem.Neurosci_13_2060
Structure7B89
CommentInhibitor of Notum Compound 7 Fragment 077 IC50 0.50+/-0.12 microM
Gene_locushuman-NOTUM
CID1475797
FamilyPectinacetylesterase-Notum
InChIKeyDMIRTDWEKUNBDX-UHFFFAOYSA-N
CanonicalSMILESC1=CC(=C(C=C1N2C=C(N=N2)CO)Cl)Cl
InChIInChI=1S/C9H7Cl2N3O/c10-8-2-1-7(3-9(8)11)14-4-6(5-15)12-13-14/h1-4,15H,5H2

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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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