Molecule ID: mol30949

SMILES: Cc1cccc(/N=N/c2c(O)ccc3cc(S(=O)(=O)O)ccc23)c1

InChI: InChI=1S/C17H14N2O4S/c1-11-3-2-4-13(9-11)18-19-17-15-7-6-14(24(21,22)23)10-12(15)5-8-16(17)20/h2-10,20H,1H3,(H,21,22,23)/b19-18+

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-1.96 AttenGpKa training set 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization