Molecule ID: mol34810

SMILES: CC(NS(=O)(=O)c1ccccc1)c1nc2ccccc2[nH]1

InChI: InChI=1S/C15H15N3O2S/c1-11(15-16-13-9-5-6-10-14(13)17-15)18-21(19,20)12-7-3-2-4-8-12/h2-11,18H,1H3,(H,16,17)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
4.78 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization