Molecule ID: mol5284

SMILES: Nc1ccc(S(=O)(=O)O)c2ccccc12

InChI: InChI=1S/C10H9NO3S/c11-9-5-6-10(15(12,13)14)8-4-2-1-3-7(8)9/h1-6H,11H2,(H,12,13,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization