Molecule ID: mol28661

SMILES: Cc1ccc(C)c(C(=O)NS(=O)(=O)c2ccc(N)cc2)c1

InChI: InChI=1S/C15H16N2O3S/c1-10-3-4-11(2)14(9-10)15(18)17-21(19,20)13-7-5-12(16)6-8-13/h3-9H,16H2,1-2H3,(H,17,18)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization