Molecule ID: mol11414

SMILES: CCC(N)(CS)c1ccccc1

InChI: InChI=1S/C10H15NS/c1-2-10(11,8-12)9-6-4-3-5-7-9/h3-7,12H,2,8,11H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.65 IUPAC digitized pKa 1 » 0
10.15 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization