Molecule ID: mol12391

SMILES: Nc1cccc[n+]1O

InChI: InChI=1S/C5H6N2O/c6-5-3-1-2-4-7(5)8/h1-4,6,8H/p+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.67 Datawarrior 1 » 0
2.67 AttenGpKa training set 1 » 0
2.67 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization