Molecule ID: mol28814

SMILES: COc1ccc(OC)c(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)c1

InChI: InChI=1S/C15H15ClN2O5S/c1-22-11-5-8-14(23-2)13(9-11)17-15(19)18-24(20,21)12-6-3-10(16)4-7-12/h3-9H,1-2H3,(H2,17,18,19)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization