Bioactive Compound Details

BioIDbio2279
NameRUZADOLANE
ChEMBL IDCHEMBL2107055
Molecular FormulaC18H19F2N5S
Molecular Weight375.45
Molecular Weight (Monoisotopic)375.1329
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsRUZADOLANE|RUZADOLANO
SmilesFc1ccc(N2CCN(CCSc3nnc4ccccn34)CC2)c(F)c1
InchiInChI=1S/C18H19F2N5S/c19-14-4-5-16(15(20)13-14)24-9-7-23(8-10-24)11-12-26-18-22-21-17-3-1-2-6-25(17)18/h1-6,13H,7-12H2
Inchi KeyLOKBLLCVOKCEFR-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-2.92
Records Key['RUZADOLANE']
Records Name['RUZADOLANE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure