Molecule ID: mol28827

SMILES: O=C(Nc1ccc(Br)cc1)NS(=O)(=O)c1ccc(Cl)cc1

InChI: InChI=1S/C13H10BrClN2O3S/c14-9-1-5-11(6-2-9)16-13(18)17-21(19,20)12-7-3-10(15)4-8-12/h1-8H,(H2,16,17,18)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.30 AttenGpKa training set 0 » -1
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Charge States and Microspecies Visualization