Bioactive Compound Details

BioIDbio197841
NameNone
ChEMBL IDCHEMBL1797708
Molecular FormulaC19H34O4
Molecular Weight326.48
Molecular Weight (Monoisotopic)326.2457
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsDiethyl-2-Dodecylidenemalonate
SmilesCCCCCCCCCCCC=C(C(=O)OCC)C(=O)OCC
InchiInChI=1S/C19H34O4/c1-4-7-8-9-10-11-12-13-14-15-16-17(18(20)22-5-2)19(21)23-6-3/h16H,4-15H2,1-3H3
Inchi KeyGKXISESEKHAPIF-UHFFFAOYSA-N
Molecular SpeciesNone
Targets6.0
Bioactivities23.0
Np Likeness Score0.44
Records Key['2b']
Records Name['diethyl-2-dodecylidenemalonate']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure