Molecule ID: mol12958

SMILES: Cc1cc(N)ccc1CN

InChI: InChI=1S/C8H12N2/c1-6-4-8(10)3-2-7(6)5-9/h2-4H,5,9-10H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.26 Datawarrior 2 » 1
9.77 Datawarrior 1 » 0
9.77 OCHEM 1 » 0
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Charge States and Microspecies Visualization