Molecule ID: mol38129

SMILES: C[S+](C)C12CCN(CC1)CC2

InChI: InChI=1S/C9H18NS/c1-11(2)9-3-6-10(7-4-9)8-5-9/h3-8H2,1-2H3/q+1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
6.62 QSARToolbox 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization