Molecule ID: mol35186

SMILES: CCCC(=O)Nc1ccc(OCC(CNC(C)C)OC(=O)C2CC2)c(C(C)=O)c1

InChI: InChI=1S/C22H32N2O5/c1-5-6-21(26)24-17-9-10-20(19(11-17)15(4)25)28-13-18(12-23-14(2)3)29-22(27)16-7-8-16/h9-11,14,16,18,23H,5-8,12-13H2,1-4H3,(H,24,26)

Experimental Macro pKa Values

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