Molecule ID: mol9905

SMILES: Cn1nc2nc(S(C)(=O)=O)[nH]c(=O)c2n1

InChI: InChI=1S/C6H7N5O3S/c1-11-9-3-4(10-11)7-6(8-5(3)12)15(2,13)14/h1-2H3,(H,7,8,10,12)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization