Bioactive Compound Details

BioIDbio1917
NameMETHDILAZINE HYDROCHLORIDE
ChEMBL IDCHEMBL1200532
Molecular FormulaC18H21ClN2S
Molecular Weight332.9
Molecular Weight (Monoisotopic)296.1347
TypeSmall molecule
Max PhasePhase 4
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsMETHDILAZINE HCL|METHDILAZINE HYDROCHLORIDE|NSC-169091|TACARYL
SmilesCN1CCC(CN2c3ccccc3Sc3ccccc32)C1.Cl
InchiInChI=1S/C18H20N2S.ClH/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;1H
Inchi KeyIEISBKIVLDXSMZ-UHFFFAOYSA-N
Molecular SpeciesBASE
Targets63.0
Bioactivities66.0
Np Likeness Score-1.01
Records Key['METHDILAZINE HYDROCHLORIDE', 'METHDILAZINE HYDROCHLORIDE', 'SID144203598', 'SID562732']
Records Name['METHDILAZINE HYDROCHLORIDE', 'METHDILAZINE HYDROCHLORIDE', 'SID144203598', 'SID562732']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure