Molecule ID: mol28666

SMILES: COc1ccc(NC(=O)NS(=O)(=O)c2ccccc2)cc1

InChI: InChI=1S/C14H14N2O4S/c1-20-12-9-7-11(8-10-12)15-14(17)16-21(18,19)13-5-3-2-4-6-13/h2-10H,1H3,(H2,15,16,17)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
5.12 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization