Molecule ID: mol36268

SMILES: O=S(=O)(Nc1ccccc1CN1CCOCCOCCN(Cc2ccccc2NS(=O)(=O)C(F)(F)F)CCOCCOCC1)C(F)(F)F

InChI: InChI=1S/C28H38F6N4O8S2/c29-27(30,31)47(39,40)35-25-7-3-1-5-23(25)21-37-9-13-43-17-19-45-15-11-38(12-16-46-20-18-44-14-10-37)22-24-6-2-4-8-26(24)36-48(41,42)28(32,33)34/h1-8,35-36H,9-22H2

Experimental Macro pKa Values

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