Molecule ID: mol37073

SMILES: COc1cc(C(=O)Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])ccc1O

InChI: InChI=1S/C14H10N2O8/c1-23-13-6-8(2-4-11(13)17)14(18)24-12-5-3-9(15(19)20)7-10(12)16(21)22/h2-7,17H,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization