Bioactive Compound Details

BioIDbio2257
NameNone
ChEMBL IDCHEMBL166112
Molecular FormulaC14H9NO2
Molecular Weight223.23
Molecular Weight (Monoisotopic)223.0633
TypeSmall molecule
Max Phase--
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
Synonyms9-Nitro-Anthracene
SmilesO=[N+]([O-])c1c2ccccc2cc2ccccc12
InchiInChI=1S/C14H9NO2/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9H
Inchi KeyLSIKFJXEYJIZNB-UHFFFAOYSA-N
Molecular SpeciesNone
Targets22.0
Bioactivities33.0
Np Likeness Score-0.48
Records Key['17', 'SID17389211', 'SID144213986', 'SID85148741']
Records Name['9-Nitro-anthracene', 'SID17389211', 'SID144213986', 'SID85148741']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure