Molecule ID: mol38252

SMILES: O=C(NCCN(CCNC(=O)c1ccccc1O)CCNC(=O)c1ccccc1O)c1ccccc1O

InChI: InChI=1S/C27H30N4O6/c32-22-10-4-1-7-19(22)25(35)28-13-16-31(17-14-29-26(36)20-8-2-5-11-23(20)33)18-15-30-27(37)21-9-3-6-12-24(21)34/h1-12,32-34H,13-18H2,(H,28,35)(H,29,36)(H,30,37)

Experimental Macro pKa Values

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