Molecule ID: mol34495

SMILES: COc1ccc(-c2cnc(-c3ccnc(N)c3)o2)cc1

InChI: InChI=1S/C15H13N3O2/c1-19-12-4-2-10(3-5-12)13-9-18-15(20-13)11-6-7-17-14(16)8-11/h2-9H,1H3,(H2,16,17)

Experimental Macro pKa Values

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