Molecule ID: mol38420

SMILES: O=C1CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc2N1CC(O)CO

InChI: InChI=1S/C18H17N3O5/c22-11-14(23)10-20-16-7-6-13(21(25)26)8-15(16)18(19-9-17(20)24)12-4-2-1-3-5-12/h1-8,14,22-23H,9-11H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization