Molecule ID: mol25172

SMILES: Cc1cc(C)[n+](O)c(C)c1

InChI: InChI=1S/C8H12NO/c1-6-4-7(2)9(10)8(3)5-6/h4-5,10H,1-3H3/q+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization