Bioactive Compound Details

BioIDbio304
NameTRIGONOSTEMONINE C
ChEMBL IDCHEMBL1957104
Molecular FormulaC21H15N3O
Molecular Weight325.37
Molecular Weight (Monoisotopic)325.1215
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsTrigonostemonine C
SmilesCOc1ccc2c(c1)[nH]c1c(-c3ccnc4ccccc34)nccc12
InchiInChI=1S/C21H15N3O/c1-25-13-6-7-15-17-9-11-23-20(21(17)24-19(15)12-13)16-8-10-22-18-5-3-2-4-14(16)18/h2-12,24H,1H3
Inchi KeyXXGIAGKWTXSGQY-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities5.0
Np Likeness Score0.06
Records Key['7']
Records Name['Trigonostemonine C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure