Molecule ID: mol26730

SMILES: CCCSc1c2ccccc2nc2ccc(OC)cc12

InChI: InChI=1S/C17H17NOS/c1-3-10-20-17-13-6-4-5-7-15(13)18-16-9-8-12(19-2)11-14(16)17/h4-9,11H,3,10H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization