Bioactive Compound Details

BioIDbio200504
NameETHANE DIMETHANE SULFONATE
ChEMBL IDCHEMBL170630
Molecular FormulaC4H10O6S2
Molecular Weight218.25
Molecular Weight (Monoisotopic)217.9919
TypeSmall molecule
Max PhasePhase 1
Target IDTar81
Target NameNone
SynonymsETHANE DIMETHANE SULFONATE|Methanesulfonic Acid 2-Methanesulfonyloxy-Ethyl Ester
SmilesCS(=O)(=O)OCCOS(C)(=O)=O
InchiInChI=1S/C4H10O6S2/c1-11(5,6)9-3-4-10-12(2,7)8/h3-4H2,1-2H3
Inchi KeyQSQFARNGNIZGAW-UHFFFAOYSA-N
Molecular SpeciesNone
Targets2.0
Bioactivities15.0
Np Likeness Score-0.22
Records Key['8', 'Ethane Dimethane Sulfonate', 'Ethane Dimethane Sulfonate', 'ETHANE DIMETHANE SULFONATE']
Records Name['Methanesulfonic acid 2-methanesulfonyloxy-ethyl ester', 'Ethane Dimethane Sulfonate', 'Ethane Dimethane Sulfonate', 'ETHANE DIMETHANE SULFONATE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure