Bioactive Compound Details

BioIDbio2285
NameETINTIDINE HYDROCHLORIDE
ChEMBL IDCHEMBL2106568
Molecular FormulaC12H17ClN6S
Molecular Weight312.83
Molecular Weight (Monoisotopic)276.1157
TypeSmall molecule
Max PhaseUnknown
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsBL-5641A|ETINTIDINE HCL|ETINTIDINE HYDROCHLORIDE
SmilesC#CCN/C(=N\C#N)NCCSCc1nc[nH]c1C.Cl
InchiInChI=1S/C12H16N6S.ClH/c1-3-4-14-12(16-8-13)15-5-6-19-7-11-10(2)17-9-18-11;/h1,9H,4-7H2,2H3,(H,17,18)(H2,14,15,16);1H
Inchi KeyBHEZOMBVJJYAFT-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-1.83
Records Key['ETINTIDINE HYDROCHLORIDE']
Records Name['ETINTIDINE HYDROCHLORIDE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure