Molecule ID: mol34830

SMILES: COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1

InChI: InChI=1S/C12H14N2O3/c1-17-8-2-3-11-9(5-8)7(6-14-11)4-10(13)12(15)16/h2-3,5-6,10,14H,4,13H2,1H3,(H,15,16)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.00 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization