Bioactive Compound Details

BioIDbio198912
NameNone
ChEMBL IDCHEMBL95190
Molecular FormulaC20H37NO4
Molecular Weight355.52
Molecular Weight (Monoisotopic)355.2723
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms4-(2-Oxohexadecanamido)Butanoic Acid
SmilesCCCCCCCCCCCCCCC(=O)C(=O)NCCCC(=O)O
InchiInChI=1S/C20H37NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18(22)20(25)21-17-14-16-19(23)24/h2-17H2,1H3,(H,21,25)(H,23,24)
Inchi KeyGCTDVJHSYNCJRN-UHFFFAOYSA-N
Molecular SpeciesACID
Targets8.0
Bioactivities17.0
Np Likeness Score0.09
Records Key['6', '5', '17', '35', 'AX-006', '19', '1, AX006', 'AX006']
Records Name['4-(2-Oxo-hexadecanoylamino)-butyric acid', '4-(2-oxohexadecanamido)butanoic acid', '4-(2-oxohexadecanamido)butanoic acid', '4-(2-oxohexadecanamido)butanoic acid', '4-(2-Oxo-hexadecanoylamino)-butyric acid', '4-(2-oxohexadecanamido)butanoic acid', '4-(2-oxohexadecanamido)butanoic acid', '4-(2-oxohexadecanamido)butanoic acid']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure