Bioactive Compound Details

BioIDbio2691
NameVABICASERIN HYDROCHLORIDE
ChEMBL IDCHEMBL2104991
Molecular FormulaC15H21ClN2
Molecular Weight264.8
Molecular Weight (Monoisotopic)228.1626
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsSCA-136|Vabicaserin hydrochloride
SmilesCl.c1cc2c3c(c1)[C@H]1CCC[C@H]1CN3CCNC2
InchiInChI=1S/C15H20N2.ClH/c1-3-11-9-16-7-8-17-10-12-4-2-5-13(12)14(6-1)15(11)17;/h1,3,6,12-13,16H,2,4-5,7-10H2;1H/t12-,13-;/m0./s1
Inchi KeyPYPPENBDXAWXJC-QNTKWALQSA-N
Molecular SpeciesBASE
TargetsNone
BioactivitiesNone
Np Likeness Score0.08
Records Key['VABICASERIN HYDROCHLORIDE', 'VABICASERIN HYDROCHLORIDE']
Records Name['VABICASERIN HYDROCHLORIDE', 'VABICASERIN HYDROCHLORIDE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure