Molecule ID: mol15528

SMILES: Cc1ccc2c(c1)ncn2[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O

InChI: InChI=1S/C13H16N2O4/c1-7-2-3-9-8(4-7)14-6-15(9)13-12(18)11(17)10(16)5-19-13/h2-4,6,10-13,16-18H,5H2,1H3/t10-,11+,12-,13-/m0/s1

Experimental Macro pKa Values

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