Bioactive Compound Details

BioIDbio3168
NameRUZOTOLIMOD
ChEMBL IDCHEMBL5095082
Molecular FormulaC14H18N4O5S
Molecular Weight354.39
Molecular Weight (Monoisotopic)354.0998
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsRG-7854|RG7854|RO-7020531|RO7020531|RUZOTOLIMOD
SmilesCC[C@H](OC(C)=O)[C@@H]1C[C@@H](O)[C@H](n2c(=O)sc3cnc(N)nc32)O1
InchiInChI=1S/C14H18N4O5S/c1-3-8(22-6(2)19)9-4-7(20)12(23-9)18-11-10(24-14(18)21)5-16-13(15)17-11/h5,7-9,12,20H,3-4H2,1-2H3,(H2,15,16,17)/t7-,8+,9+,12-/m1/s1
Inchi KeyOJEUDXXMKNXHST-JDVQERKKSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score0.7
Records Key['RUZOTOLIMOD', 'RUZOTOLIMOD']
Records Name['RUZOTOLIMOD', 'RUZOTOLIMOD']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure