Molecule ID: mol28751

SMILES: O=C(c1ccccc1)c1cccc(NS(=O)(=O)C(F)(F)F)c1

InChI: InChI=1S/C14H10F3NO3S/c15-14(16,17)22(20,21)18-12-8-4-7-11(9-12)13(19)10-5-2-1-3-6-10/h1-9,18H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization