Molecule ID: mol7294

SMILES: CCC(=O)Nc1c(N)nc(N)nc1O

InChI: InChI=1S/C7H11N5O2/c1-2-3(13)10-4-5(8)11-7(9)12-6(4)14/h2H2,1H3,(H,10,13)(H5,8,9,11,12,14)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.62 IUPAC digitized pKa 1 » 0
10.18 IUPAC digitized pKa 0 » -1
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Charge States and Microspecies Visualization