Molecule ID: mol37784

SMILES: O=C(O)[C@@H](O)Cc1c[nH]cn1

InChI: InChI=1S/C6H8N2O3/c9-5(6(10)11)1-4-2-7-3-8-4/h2-3,5,9H,1H2,(H,7,8)(H,10,11)/t5-/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.99 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization