Bioactive Compound Details

BioIDbio198197
Name2-NONENAL
ChEMBL IDCHEMBL450072
Molecular FormulaC9H16O
Molecular Weight140.23
Molecular Weight (Monoisotopic)140.1201
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms(E)-2-Nonenal|2-Nonenal
SmilesCCCCCC/C=C/C=O
InchiInChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h7-9H,2-6H2,1H3/b8-7+
Inchi KeyBSAIUMLZVGUGKX-BQYQJAHWSA-N
Molecular SpeciesNEUTRAL
Targets18.0
Bioactivities22.0
Np Likeness Score2.23
Records Key['3', '2E-C9:1-Ald', 'SID144211132', '2-Nonenal', '1', '40']
Records Name['(E)-2-nonenal', '(E)-non-2-enal', 'SID144211132', '2-Nonenal', '(E)-non-2-enal', 'non-2-enal']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure