Molecule ID: mol34811

SMILES: CC(N/C(=C\[N+](=O)[O-])Nc1cccc(C#N)c1)C(C)(C)C

InChI: InChI=1S/C15H20N4O2/c1-11(15(2,3)4)17-14(10-19(20)21)18-13-7-5-6-12(8-13)9-16/h5-8,10-11,17-18H,1-4H3/b14-10+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization