Type : Fragment inhibitor of Notum, Pyridine, Sulfur Compound
Chemical_Nomenclature : 2-(3-nitropyridin-2-yl)sulfanylacetic acid
Canonical SMILES : C1=CC(=C(N=C1)SCC(=O)O)[N+](=O)[O-]
InChI : InChI=1S\/C7H6N2O4S\/c10-6(11)4-14-7-5(9(12)13)2-1-3-8-7\/h1-3H,4H2,(H,10,11)
InChIKey : WBPUHBNGHSAAGT-UHFFFAOYSA-N
Other name(s) : U2Q || 2-[(3-nitro-2-pyridyl)thio]acetic acid || NSC101844 || 2-((3-Nitropyridin-2-yl)thio)acetic acid || CHEMBL1742002 || SCHEMBL13401781 || SCHEMBL17229241 || ZINC169889 || Maybridge1_004963
MW : 214.20
Formula : C7H6N2O4S
CAS_number : 18504-80-8
PubChem : 265630
UniChem : WBPUHBNGHSAAGT-UHFFFAOYSA-N
Families : Maybridge_18 ligand of proteins in family
Pectinacetylesterase-Notum
Structure :
7BLS
Protein :
human-NOTUM
No reference