Molecule ID: mol34391

SMILES: COc1ccc(NC(=O)CN)cc1

InChI: InChI=1S/C9H12N2O2/c1-13-8-4-2-7(3-5-8)11-9(12)6-10/h2-5H,6,10H2,1H3,(H,11,12)

Experimental Macro pKa Values

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