Molecule ID: mol24309

SMILES: CNCCCCCSc1ccccc1

InChI: InChI=1S/C12H19NS/c1-13-10-6-3-7-11-14-12-8-4-2-5-9-12/h2,4-5,8-9,13H,3,6-7,10-11H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.90 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization