Molecule ID: mol16402

SMILES: CC1=NN(c2ccc(OCCCO[N+](=O)[O-])cc2)C(=O)C1

InChI: InChI=1S/C13H15N3O5/c1-10-9-13(17)15(14-10)11-3-5-12(6-4-11)20-7-2-8-21-16(18)19/h3-6H,2,7-9H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.11 Baltruschat ChEMBL 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization