Molecule ID: mol36187

SMILES: O=C(O)COc1ccc(S(=O)(=O)Nc2cc(-c3nccs3)ccc2-c2nc3ccccc3[nH]2)cc1

InChI: InChI=1S/C24H18N4O5S2/c29-22(30)14-33-16-6-8-17(9-7-16)35(31,32)28-21-13-15(24-25-11-12-34-24)5-10-18(21)23-26-19-3-1-2-4-20(19)27-23/h1-13,28H,14H2,(H,26,27)(H,29,30)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.30 QSARToolbox -1 » -2
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Charge States and Microspecies Visualization