Molecule ID: mol38055

SMILES: COCCNCCOP(=O)(O)Oc1ccc(C#N)cc1

InChI: InChI=1S/C12H17N2O5P/c1-17-8-6-14-7-9-18-20(15,16)19-12-4-2-11(10-13)3-5-12/h2-5,14H,6-9H2,1H3,(H,15,16)

Experimental Macro pKa Values

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