Molecule ID: mol34608

SMILES: COc1ccc(C2=NN(c3ccccc3)C(c3ccccc3C(=O)O)C2)cc1

InChI: InChI=1S/C23H20N2O3/c1-28-18-13-11-16(12-14-18)21-15-22(19-9-5-6-10-20(19)23(26)27)25(24-21)17-7-3-2-4-8-17/h2-14,22H,15H2,1H3,(H,26,27)

Experimental Macro pKa Values

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