Molecule ID: mol26232

SMILES: C[n+]1cnc(O)c2ncc(N)nc21

InChI: InChI=1S/C7H7N5O/c1-12-3-10-7(13)5-6(12)11-4(8)2-9-5/h2-3H,1H3,(H2,8,11,13)/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization