Bioactive Compound Details

BioIDbio2522
NameHEXAPRADOL
ChEMBL IDCHEMBL2107201
Molecular FormulaC19H25NO
Molecular Weight283.42
Molecular Weight (Monoisotopic)283.1936
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsHEXAPRADOL
SmilesCCCCCC(N)C(O)(c1ccccc1)c1ccccc1
InchiInChI=1S/C19H25NO/c1-2-3-6-15-18(20)19(21,16-11-7-4-8-12-16)17-13-9-5-10-14-17/h4-5,7-14,18,21H,2-3,6,15,20H2,1H3
Inchi KeyZVRZJTRBWTVKOJ-UHFFFAOYSA-N
Molecular SpeciesBASE
TargetsNone
BioactivitiesNone
Np Likeness Score0.12
Records Key['HEXAPRADOL']
Records Name['HEXAPRADOL']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure