Bioactive Compound Details

BioIDbio2525
NameNone
ChEMBL IDCHEMBL83371
Molecular FormulaC13H8OS
Molecular Weight212.27
Molecular Weight (Monoisotopic)212.0296
TypeSmall molecule
Max Phase--
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsThioxanthen-9-One
SmilesO=c1c2ccccc2sc2ccccc12
InchiInChI=1S/C13H8OS/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H
Inchi KeyYRHRIQCWCFGUEQ-UHFFFAOYSA-N
Molecular SpeciesNone
Targets68.0
Bioactivities71.0
Np Likeness Score-0.72
Records Key['3', 'SID508071', 'SID89850677']
Records Name['Thioxanthen-9-one', 'SID508071', 'SID89850677']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure