Molecule ID: mol36118

SMILES: O=C(O)CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1

InChI: InChI=1S/C10H9N3O7/c14-9(15)1-2-11-10(16)6-3-7(12(17)18)5-8(4-6)13(19)20/h3-5H,1-2H2,(H,11,16)(H,14,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.80 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization