Bioactive Compound Details

BioIDbio200314
NameNone
ChEMBL IDCHEMBL218762
Molecular FormulaC5H4N4OS
Molecular Weight168.18
Molecular Weight (Monoisotopic)168.0106
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Thioxanthine
SmilesO=c1[nH]c(S)nc2[nH]cnc12
InchiInChI=1S/C5H4N4OS/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)
Inchi KeyXNHFAGRBSMMFKL-UHFFFAOYSA-N
Molecular SpeciesACID
Targets4.0
Bioactivities5.0
Np Likeness Score-0.64
Records Key['2-thioxanthine', 'SID26755590', '84']
Records Name['2-thioxanthine', 'SID26755590', None]
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure