Molecule ID: mol36157

SMILES: O=C(O)CN(CCN(CCN(CC(=O)O)CC(=O)O)CP(=O)(O)CN(Cc1ccccc1)Cc1ccccc1)CC(=O)O

InChI: InChI=1S/C28H39N4O10P/c33-25(34)17-30(18-26(35)36)13-11-29(12-14-31(19-27(37)38)20-28(39)40)21-43(41,42)22-32(15-23-7-3-1-4-8-23)16-24-9-5-2-6-10-24/h1-10H,11-22H2,(H,33,34)(H,35,36)(H,37,38)(H,39,40)(H,41,42)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.10 QSARToolbox -3 » -4
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Charge States and Microspecies Visualization