Molecule ID: mol28533

SMILES: N#Cc1ccc(NS(=O)(=O)c2ccc(N)cc2)cc1

InChI: InChI=1S/C13H11N3O2S/c14-9-10-1-5-12(6-2-10)16-19(17,18)13-7-3-11(15)4-8-13/h1-8,16H,15H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization