Bioactive Compound Details

BioIDbio2963
NameFADOLMIDINE
ChEMBL IDCHEMBL2104262
Molecular FormulaC13H14N2O
Molecular Weight214.27
Molecular Weight (Monoisotopic)214.1106
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsFADOLMIDINA|FADOLMIDINE|RADOLMIDINE
SmilesOc1ccc2c(c1)C(Cc1c[nH]cn1)CC2
InchiInChI=1S/C13H14N2O/c16-12-4-3-9-1-2-10(13(9)6-12)5-11-7-14-8-15-11/h3-4,6-8,10,16H,1-2,5H2,(H,14,15)
Inchi KeyVTZPAJGVRWKMAG-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score0.83
Records Key['FADOLMIDINE']
Records Name['FADOLMIDINE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure