Molecule ID: mol28534

SMILES: N#Cc1cccc(NS(=O)(=O)c2ccc(N)cc2)c1

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

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization