Bioactive Compound Details

BioIDbio48
NameNOCAZINE C
ChEMBL IDCHEMBL1835447
Molecular FormulaC20H20N2O3
Molecular Weight336.39
Molecular Weight (Monoisotopic)336.1474
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonymsnocazine C
SmilesCOc1ccc(/C=C2/C(=O)N[C@@H](Cc3ccccc3)C(=O)N2C)cc1
InchiInChI=1S/C20H20N2O3/c1-22-18(13-15-8-10-16(25-2)11-9-15)19(23)21-17(20(22)24)12-14-6-4-3-5-7-14/h3-11,13,17H,12H2,1-2H3,(H,21,23)/b18-13-/t17-/m0/s1
Inchi KeyLNJXHMVOPQVJDF-XIDKLXSXSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score0.32
Records Key['6, nocazine C']
Records Name['(3S,6Z)-3-benzyl-6-(4-methoxybenzylidene)-1-methylpiperazine-2,5-dione']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure