Molecule ID: mol14813

SMILES: Nc1cccc2nnn([C@@H]3C[C@@H](O)[C@H](CO)O3)c12

InChI: InChI=1S/C11H14N4O3/c12-6-2-1-3-7-11(6)15(14-13-7)10-4-8(17)9(5-16)18-10/h1-3,8-10,16-17H,4-5,12H2/t8-,9+,10+/m1/s1

Experimental Macro pKa Values

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