Molecule ID: mol4733

SMILES: CC(C)Oc1nc(N)nc2nccnc12

InChI: InChI=1S/C9H11N5O/c1-5(2)15-8-6-7(12-4-3-11-6)13-9(10)14-8/h3-5H,1-2H3,(H2,10,12,13,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization