Molecule ID: mol36408

SMILES: CN(C)c1ccc(/N=N/c2ccc(CCC(=O)O)cc2)cc1

InChI: InChI=1S/C17H19N3O2/c1-20(2)16-10-8-15(9-11-16)19-18-14-6-3-13(4-7-14)5-12-17(21)22/h3-4,6-11H,5,12H2,1-2H3,(H,21,22)/b19-18+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization