Molecule ID: mol28404

SMILES: O=S(=O)(O)Nc1cccc2ccccc12

InChI: InChI=1S/C10H9NO3S/c12-15(13,14)11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H,(H,12,13,14)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-1.45 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization