Molecule ID: mol1573

SMILES: O[C@H](c1ccccc1)[C@@H]1CCCCN1

InChI: InChI=1S/C12H17NO/c14-12(10-6-2-1-3-7-10)11-8-4-5-9-13-11/h1-3,6-7,11-14H,4-5,8-9H2/t11-,12+/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
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Charge States and Microspecies Visualization