Molecule ID: mol33700

SMILES: COC1=NC=[N+]C(S)=C1C

InChI: InChI=1S/C6H8N2OS/c1-4-5(9-2)7-3-8-6(4)10/h3H,1-2H3,(H,7,10)/q+1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-1.59 OCHEM 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization