Molecule ID: mol8078

SMILES: CN(C)c1nc(N)c2ncc(=O)[nH]c2n1

InChI: InChI=1S/C8H10N6O/c1-14(2)8-12-6(9)5-7(13-8)11-4(15)3-10-5/h3H,1-2H3,(H3,9,11,12,13,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.57 IUPAC digitized pKa 1 » 0
8.81 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization