Molecule ID: mol11046

SMILES: Nc1nc2c(c(C(=O)O)n1)CCCC2

InChI: InChI=1S/C9H11N3O2/c10-9-11-6-4-2-1-3-5(6)7(12-9)8(13)14/h1-4H2,(H,13,14)(H2,10,11,12)

Experimental Macro pKa Values

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