Molecule ID: mol37962

SMILES: O=S(=O)(O)Cc1ccc(CN(CCN(Cc2ccccn2)Cc2ccccn2)Cc2ccccn2)cc1

InChI: InChI=1S/C28H31N5O3S/c34-37(35,36)23-25-12-10-24(11-13-25)19-32(20-26-7-1-4-14-29-26)17-18-33(21-27-8-2-5-15-30-27)22-28-9-3-6-16-31-28/h1-16H,17-23H2,(H,34,35,36)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.86 QSARToolbox 3 » 2
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Charge States and Microspecies Visualization