Molecule ID: mol1981

SMILES: NC1=N[C@H](c2ccco2)Nc2ccccc21

InChI: InChI=1S/C12H11N3O/c13-11-8-4-1-2-5-9(8)14-12(15-11)10-6-3-7-16-10/h1-7,12,14H,(H2,13,15)/t12-/m1/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
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Charge States and Microspecies Visualization