Molecule ID: mol37487

SMILES: O=[N+]([O-])c1ccc(N=Nc2cc3c(O)c(c2)COCCOCCOCCOCCOCCOC3)c([N+](=O)[O-])c1

InChI: InChI=1S/C24H30N4O11/c29-24-18-13-20(25-26-22-2-1-21(27(30)31)15-23(22)28(32)33)14-19(24)17-39-12-10-37-8-6-35-4-3-34-5-7-36-9-11-38-16-18/h1-2,13-15,29H,3-12,16-17H2

Experimental Macro pKa Values

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