Bioactive Compound Details

BioIDbio950
NameCARDIOGENOL C
ChEMBL IDCHEMBL1241078
Molecular FormulaC13H16N4O2
Molecular Weight260.3
Molecular Weight (Monoisotopic)260.1273
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsCardiogenol C
SmilesCOc1ccc(Nc2nccc(NCCO)n2)cc1
InchiInChI=1S/C13H16N4O2/c1-19-11-4-2-10(3-5-11)16-13-15-7-6-12(17-13)14-8-9-18/h2-7,18H,8-9H2,1H3,(H2,14,15,16,17)
Inchi KeyLKBSMPFEKIBRGC-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets7.0
Bioactivities16.0
Np Likeness Score-1.19
Records Key['SID174007243', 'CgC', 'cardiogenol-c', 'CARDIOGENOL-C', 'Cardiogenol C', 'cardiogenol-c', 'cardiogenol-c']
Records Name['SID174007243', 'Cardiogenol C', 'cardiogenol-c', 'CARDIOGENOL-C', 'Cardiogenol C', 'cardiogenol-c', 'cardiogenol-c']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure