Molecule ID: mol14397

SMILES: Cc1c(Cc2c(C)n(C)[n+](-c3ccccc3)c2O)c(=O)n(-c2ccccc2)n1C

InChI: InChI=1S/C23H24N4O2/c1-16-20(22(28)26(24(16)3)18-11-7-5-8-12-18)15-21-17(2)25(4)27(23(21)29)19-13-9-6-10-14-19/h5-14H,15H2,1-4H3/p+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.51 Datawarrior 2 » 1
1.51 OCHEM 2 » 1
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Charge States and Microspecies Visualization