Molecule ID: mol3377

SMILES: Cc1ccccc1Nc1ccc(S(N)(=O)=O)cc1

InChI: InChI=1S/C13H14N2O2S/c1-10-4-2-3-5-13(10)15-11-6-8-12(9-7-11)18(14,16)17/h2-9,15H,1H3,(H2,14,16,17)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.04 IUPAC digitized pKa 1 » 0
9.96 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization