Bioactive Compound Details

BioIDbio2507
NameNone
ChEMBL IDCHEMBL1927686
Molecular FormulaC17H15ClN2
Molecular Weight282.77
Molecular Weight (Monoisotopic)246.1157
TypeSmall molecule
Max Phase--
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
Synonyms9-Methylisocryptolepine Hydrochloride
SmilesCc1ccc2c3cn(C)c4ccccc4c-3nc2c1.Cl
InchiInChI=1S/C17H14N2.ClH/c1-11-7-8-12-14-10-19(2)16-6-4-3-5-13(16)17(14)18-15(12)9-11;/h3-10H,1-2H3;1H
Inchi KeyYFPMFCWEOPWNEN-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities4.0
Np Likeness Score-0.77
Records Key['3e']
Records Name['9-Methylisocryptolepine hydrochloride']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure