Molecule ID: mol12143

SMILES: O=S(=O)(O)c1cc(S(=O)(=O)O)c2c(N=Nc3ccc(Cl)cc3)c(O)ccc2c1

InChI: InChI=1S/C16H11ClN2O7S2/c17-10-2-4-11(5-3-10)18-19-16-13(20)6-1-9-7-12(27(21,22)23)8-14(15(9)16)28(24,25)26/h1-8,20H,(H,21,22,23)(H,24,25,26)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.00 IUPAC digitized pKa -2 » -3
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Charge States and Microspecies Visualization