Molecule ID: mol25236

SMILES: Cc1c[nH]nc1O

InChI: InChI=1S/C4H6N2O/c1-3-2-5-6-4(3)7/h2H,1H3,(H2,5,6,7)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization