Molecule ID: mol35408

SMILES: CCCCOC(=S)NC(=O)c1ccccc1

InChI: InChI=1S/C12H15NO2S/c1-2-3-9-15-12(16)13-11(14)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3,(H,13,14,16)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.13 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization