Molecule ID: mol25781

SMILES: O=C(O)N1C=NN(C(=O)O)C=N1

InChI: InChI=1S/C4H4N4O4/c9-3(10)7-1-5-8(2-6-7)4(11)12/h1-2H,(H,9,10)(H,11,12)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization