Bioactive Compound Details

BioIDbio1031
NameSEMIPLENAMIDE C
ChEMBL IDCHEMBL453231
Molecular FormulaC20H39NO2
Molecular Weight325.54
Molecular Weight (Monoisotopic)325.2981
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsSemiplenamide C
SmilesCCCCCCCCCCCCC/C=C(\C)C(=O)N[C@@H](C)CO
InchiInChI=1S/C20H39NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18(2)20(23)21-19(3)17-22/h16,19,22H,4-15,17H2,1-3H3,(H,21,23)/b18-16+/t19-/m0/s1
Inchi KeyYATFRALIAPYFQO-YMIFCHIISA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score0.66
Records Key['3']
Records Name['Semiplenamide C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure