Bioactive Compound Details

BioIDbio199725
NameNone
ChEMBL IDCHEMBL333481
Molecular FormulaC17H14N2
Molecular Weight246.31
Molecular Weight (Monoisotopic)246.1157
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Methylneocryptolepine
SmilesCc1ccc2c(c1)cc1c3ccccc3nc-1n2C
InchiInChI=1S/C17H14N2/c1-11-7-8-16-12(9-11)10-14-13-5-3-4-6-15(13)18-17(14)19(16)2/h3-10H,1-2H3
Inchi KeyZMZIXUJJBXGEFQ-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities7.0
Np Likeness Score-0.88
Records Key['1g', 'SI, 2-methylneocryptolepine']
Records Name['7,10-Dimethyl-10H-10,11-diaza-benzo[b]fluorene', '2-methylneocryptolepine']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure