Molecule ID: mol25267

SMILES: Cc1[nH]nc(O)c1C

InChI: InChI=1S/C5H8N2O/c1-3-4(2)6-7-5(3)8/h1-2H3,(H2,6,7,8)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization