Bioactive Compound Details

BioIDbio197822
NameNone
ChEMBL IDCHEMBL454739
Molecular FormulaC8H8O3
Molecular Weight152.15
Molecular Weight (Monoisotopic)152.0473
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2',6'-Dihydroxyacetophenone|2, 6-Dihydroxyacetophenone|2,6-Dihydroxy Acetophenone
SmilesCC(=O)c1c(O)cccc1O
InchiInChI=1S/C8H8O3/c1-5(9)8-6(10)3-2-4-7(8)11/h2-4,10-11H,1H3
Inchi KeyYPTJKHVBDCRKNF-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets13.0
Bioactivities23.0
Np Likeness Score0.57
Records Key['E', '20', 2',6'-dihydroxyacetophenone", 'SID29217766', '3', '2b', '2,6-Dihydroxyacetophenone', '9']"
Records Name['2,6-dihydroxy acetophenone', '2, 6-dihydroxyacetophenone', 2',6'-dihydroxyacetophenone", 'SID29217766', '1-(2,6-dihydroxyphenyl)ethanone', '2,6-Dihydroxyacetophenone', '2,6-Dihydroxyacetophenone', '2,6-dihydroxyacetophenone']"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure