Molecule ID: mol28808

SMILES: Cc1ccc(S(=O)(=O)Nc2ccccc2/C=N/Nc2ccccc2)cc1

InChI: InChI=1S/C20H19N3O2S/c1-16-11-13-19(14-12-16)26(24,25)23-20-10-6-5-7-17(20)15-21-22-18-8-3-2-4-9-18/h2-15,22-23H,1H3/b21-15+

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
10.90 AttenGpKa training set -1 » -2
11.00 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization