Molecule ID: mol36006

SMILES: O=C(O)CC(O)(CC(=O)O)C(=O)Nc1ccccc1

InChI: InChI=1S/C12H13NO6/c14-9(15)6-12(19,7-10(16)17)11(18)13-8-4-2-1-3-5-8/h1-5,19H,6-7H2,(H,13,18)(H,14,15)(H,16,17)

Experimental Macro pKa Values

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