Molecule ID: mol28711

SMILES: COc1ccccc1NC(=O)NS(=O)(=O)c1ccc(C)cc1

InChI: InChI=1S/C15H16N2O4S/c1-11-7-9-12(10-8-11)22(19,20)17-15(18)16-13-5-3-4-6-14(13)21-2/h3-10H,1-2H3,(H2,16,17,18)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization