Molecule ID: mol12971

SMILES: O=C1CS(=O)(=O)NC(=O)N1

InChI: InChI=1S/C3H4N2O4S/c6-2-1-10(8,9)5-3(7)4-2/h1H2,(H2,4,5,6,7)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.70 Datawarrior 0 » -1
2.70 OCHEM 0 » -1
2.88 AttenGpKa training set 0 » -1
11.00 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization