Molecule ID: mol28465

SMILES: NS(=O)(=O)Oc1ccc(Br)cc1

InChI: InChI=1S/C6H6BrNO3S/c7-5-1-3-6(4-2-5)11-12(8,9)10/h1-4H,(H2,8,9,10)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.92 AttenGpKa training set 0 » -1
9.29 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization