Molecule ID: mol34481

SMILES: CC(C)NCC(O)COc1ccc(NC=O)cc1

InChI: InChI=1S/C13H20N2O3/c1-10(2)14-7-12(17)8-18-13-5-3-11(4-6-13)15-9-16/h3-6,9-10,12,14,17H,7-8H2,1-2H3,(H,15,16)

Experimental Macro pKa Values

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