Molecule ID: mol28634

SMILES: O=S(=O)(NCc1ccccc1)c1ccc2ccccc2n1

InChI: InChI=1S/C16H14N2O2S/c19-21(20,17-12-13-6-2-1-3-7-13)16-11-10-14-8-4-5-9-15(14)18-16/h1-11,17H,12H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization