Bioactive Compound Details

BioIDbio199570
NameNone
ChEMBL IDCHEMBL1797713
Molecular FormulaC22H42O4
Molecular Weight370.57
Molecular Weight (Monoisotopic)370.3083
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsDiethyl-2-Pentadecylmalonate
SmilesCCCCCCCCCCCCCCCC(C(=O)OCC)C(=O)OCC
InchiInChI=1S/C22H42O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21(23)25-5-2)22(24)26-6-3/h20H,4-19H2,1-3H3
Inchi KeyGCBMLYCDKPXHAI-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities7.0
Np Likeness Score0.11
Records Key['4c']
Records Name['diethyl-2-pentadecylmalonate']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure