Molecule ID: mol16751

SMILES: CCCC(C(=O)Nc1c(C)cccc1C)N(CC)CC

InChI: InChI=1S/C17H28N2O/c1-6-10-15(19(7-2)8-3)17(20)18-16-13(4)11-9-12-14(16)5/h9,11-12,15H,6-8,10H2,1-5H3,(H,18,20)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.89 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization