Molecule ID: mol23842

SMILES: O=[N+]([O-])c1ccc(NCO)cc1F

InChI: InChI=1S/C7H7FN2O3/c8-6-3-5(9-4-11)1-2-7(6)10(12)13/h1-3,9,11H,4H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-2.20 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization