Bioactive Compound Details

BioIDbio2328
NameLUROSETRON
ChEMBL IDCHEMBL2105137
Molecular FormulaC17H17FN4O
Molecular Weight312.35
Molecular Weight (Monoisotopic)312.1386
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsGR-87442|LUROSETRON
SmilesCc1[nH]cnc1CN1CCc2c(c3cccc(F)c3n2C)C1=O
InchiInChI=1S/C17H17FN4O/c1-10-13(20-9-19-10)8-22-7-6-14-15(17(22)23)11-4-3-5-12(18)16(11)21(14)2/h3-5,9H,6-8H2,1-2H3,(H,19,20)
Inchi KeyNUMKWGDDRWJQMY-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-1.04
Records KeyNone
Records NameNone
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure