Molecule ID: mol14424

SMILES: CN(C)c1cccc2c(S(=O)(=O)NCCN3CCNCCNCCNCC3)cccc12

InChI: InChI=1S/C22H36N6O2S/c1-27(2)21-7-3-6-20-19(21)5-4-8-22(20)31(29,30)26-15-18-28-16-13-24-11-9-23-10-12-25-14-17-28/h3-8,23-26H,9-18H2,1-2H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.03 QSARToolbox 4 » 3
11.80 Datawarrior 0 » -1
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Charge States and Microspecies Visualization