Molecule ID: mol32191

SMILES: Cc1snc(O)c1CC(N)C(=O)O

InChI: InChI=1S/C7H10N2O3S/c1-3-4(6(10)9-13-3)2-5(8)7(11)12/h5H,2,8H2,1H3,(H,9,10)(H,11,12)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
1.84 OCHEM 1 » 0
7.00 OCHEM 0 » -1
10.27 OCHEM -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization