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Inhibitor Report for: 2-(1,2-Dihydroacenaphthylen-5-ylsulfanyl)acetic-acid

General
Type Fragment inhibitor of Notum, Naphthalen, Sulfur Compound
Chemical_Nomenclature 2-(1,2-dihydroacenaphthylen-5-ylsulfanyl)acetic acid
Canonical SMILES C1CC2=CC=C(C3=CC=CC1=C23)SCC(=O)O
InChI InChI=1S/C14H12O2S/c15-13(16)8-17-12-7-6-10-5-4-9-2-1-3-11(12)14(9)10/h1-3,6-7H,4-5,8H2,(H,15,16)
InChIKey ILIYQPKGPUGGBV-UHFFFAOYSA-N
Other name(s) 2-(1,2-dihydroacenaphthylen-5-ylsulfanyl)acetic acid ; Enamine_005563 ; HMS1409M19 ; ZINC3315933 ; fragment_126 ; U5B
________________________________________________________________________________________________
MW|244.31
Formula|C14H12O2S
CAS_number|565170-66-3
PubChem|2431658
UniChem|ILIYQPKGPUGGBV-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | 2-(1,2-Dihydroacenaphthylen-5-ylsulfanyl)acetic-acid ligand of proteins in family: Pectinacetylesterase-Notum
Stucture | 1 structure: 7BNC: Human Notum complexed with fragment_126 (2-(1,2-dihydroacenaphthylen-5-ylsulfanyl)acetic acid)
Protein | human-NOTUM

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