Molecule ID: mol35416

SMILES: CCCCOc1cccc(NC(=O)OCCN(CC)CC)c1

InChI: InChI=1S/C17H28N2O3/c1-4-7-12-21-16-10-8-9-15(14-16)18-17(20)22-13-11-19(5-2)6-3/h8-10,14H,4-7,11-13H2,1-3H3,(H,18,20)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.68 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization