Molecule ID: mol37896

SMILES: CC(C)c1ccccc1N/N=C1\C(=O)c2ccc(S(=O)(=O)O)cc2C=C1S(=O)(=O)O

InChI: InChI=1S/C19H18N2O7S2/c1-11(2)14-5-3-4-6-16(14)20-21-18-17(30(26,27)28)10-12-9-13(29(23,24)25)7-8-15(12)19(18)22/h3-11,20H,1-2H3,(H,23,24,25)(H,26,27,28)/b21-18-

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
12.00 QSARToolbox -2 » -3
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Charge States and Microspecies Visualization