Molecule ID: mol37079

SMILES: COc1ccc(C(C(C#N)C#N)N2CCCCC2)cc1

InChI: InChI=1S/C16H19N3O/c1-20-15-7-5-13(6-8-15)16(14(11-17)12-18)19-9-3-2-4-10-19/h5-8,14,16H,2-4,9-10H2,1H3

Experimental Macro pKa Values

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