Molecule ID: mol32752

SMILES: CCOc1ccc2nccc(C(O)C3CC4CCN3CC4CC)c2c1

InChI: InChI=1S/C21H28N2O2/c1-3-14-13-23-10-8-15(14)11-20(23)21(24)17-7-9-22-19-6-5-16(25-4-2)12-18(17)19/h5-7,9,12,14-15,20-21,24H,3-4,8,10-11,13H2,1-2H3

Experimental Macro pKa Values

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