Bioactive Compound Details

BioIDbio198456
NameNone
ChEMBL IDCHEMBL118340
Molecular FormulaC16H11IN2
Molecular Weight358.18
Molecular Weight (Monoisotopic)357.9967
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Iodoneocryptolepine
SmilesCn1c2nc3ccccc3c-2cc2cc(I)ccc21
InchiInChI=1S/C16H11IN2/c1-19-15-7-6-11(17)8-10(15)9-13-12-4-2-3-5-14(12)18-16(13)19/h2-9H,1H3
Inchi KeyPAKJOXBWULIZGV-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities10.0
Np Likeness Score-1.13
Records Key['SI, 2-iodoneocryptolepine', '1f']
Records Name['2-iodoneocryptolepine', '7-Iodo-10-methyl-10H-10,11-diaza-benzo[b]fluorene']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure