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Inhibitor Report for: Maybridge_18

General
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
IUPHAR|
Wikipedia|

Target
Families | Maybridge_18 ligand of proteins in family: Pectinacetylesterase-Notum
Stucture | 1 structure: 7BLS: Human Notum-maybridge_18
Protein | human-NOTUM

References:
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