Bioactive Compound Details

BioIDbio3059
NameMETHDILAZINE
ChEMBL IDCHEMBL1200959
Molecular FormulaC18H20N2S
Molecular Weight296.44
Molecular Weight (Monoisotopic)296.1347
TypeSmall molecule
Max PhasePhase 4
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsMETDILAZINA|METHDILAZINE|TACARYL
SmilesCN1CCC(CN2c3ccccc3Sc3ccccc32)C1
InchiInChI=1S/C18H20N2S/c1-19-11-10-14(12-19)13-20-15-6-2-4-8-17(15)21-18-9-5-3-7-16(18)20/h2-9,14H,10-13H2,1H3
Inchi KeyHTMIBDQKFHUPSX-UHFFFAOYSA-N
Molecular SpeciesBASE
Targets4.0
Bioactivities9.0
Np Likeness Score-1.01
Records Key['METHDILAZINE', 'METHDILAZINE', 'COVC-0678151537', 'METHDILAZINE', '87']
Records Name['METHDILAZINE', 'METHDILAZINE', 'METHDILAZINE', 'METHDILAZINE', 'Methdilazine']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure