Molecule ID: mol23713

SMILES: NC(=O)c1ccccc1N

InChI: InChI=1S/C7H8N2O/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H2,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization