Molecule ID: mol37029

SMILES: Cc1cc[n+](CC(=NO)c2ccccc2)c2ccccc12

InChI: InChI=1S/C18H16N2O/c1-14-11-12-20(18-10-6-5-9-16(14)18)13-17(19-21)15-7-3-2-4-8-15/h2-12H,13H2,1H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization