Bioactive Compound Details

BioIDbio2988
NameSELODENOSON
ChEMBL IDCHEMBL2107371
Molecular FormulaC17H24N6O4
Molecular Weight376.42
Molecular Weight (Monoisotopic)376.1859
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsDTI-0009|GR-56072|GR56072|RG-14202|SELODENOSON|Selodenoson
SmilesCCNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O
InchiInChI=1S/C17H24N6O4/c1-2-18-16(26)13-11(24)12(25)17(27-13)23-8-21-10-14(19-7-20-15(10)23)22-9-5-3-4-6-9/h7-9,11-13,17,24-25H,2-6H2,1H3,(H,18,26)(H,19,20,22)/t11-,12+,13-,17+/m0/s1
Inchi KeyGWVQGVCXFNYGFP-PFHKOEEOSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score0.04
Records Key['SELODENOSON', 'SELODENOSON']
Records Name['SELODENOSON', 'SELODENOSON']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure