Molecule ID: mol37151

SMILES: O=P(O)(O)CCN1CCN(CCP(=O)(O)O)CCN(CCP(=O)(O)O)CC1

InChI: InChI=1S/C12H30N3O9P3/c16-25(17,18)10-7-13-1-2-14(8-11-26(19,20)21)5-6-15(4-3-13)9-12-27(22,23)24/h1-12H2,(H2,16,17,18)(H2,19,20,21)(H2,22,23,24)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.38 QSARToolbox -1 » -2
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Charge States and Microspecies Visualization