Bioactive Compound Details

BioIDbio2641
NameLORCINADOL
ChEMBL IDCHEMBL2106757
Molecular FormulaC17H19ClN4
Molecular Weight314.82
Molecular Weight (Monoisotopic)314.1298
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsLORCINADOL|R 62 818|R 62818|R-62-818
SmilesClc1ccc(N2CCN(C/C=C/c3ccccc3)CC2)nn1
InchiInChI=1S/C17H19ClN4/c18-16-8-9-17(20-19-16)22-13-11-21(12-14-22)10-4-7-15-5-2-1-3-6-15/h1-9H,10-14H2/b7-4+
Inchi KeyNCPBMOFVRBEVJY-QPJJXVBHSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities2.0
Np Likeness Score-1.73
Records Key['LORCINADOL', 'COVC-0677924408']
Records Name['LORCINADOL', 'LORCINADOL']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure