Molecule ID: mol36401

SMILES: CN(C)c1ccc(N=Nc2ccc(/C=C/C(=O)O)cc2)cc1

InChI: InChI=1S/C17H17N3O2/c1-20(2)16-10-8-15(9-11-16)19-18-14-6-3-13(4-7-14)5-12-17(21)22/h3-12H,1-2H3,(H,21,22)/b12-5+,19-18?

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization