Molecule ID: mol2864

SMILES: COc1ccc(SCCc2ccncc2)cc1

InChI: InChI=1S/C14H15NOS/c1-16-13-2-4-14(5-3-13)17-11-8-12-6-9-15-10-7-12/h2-7,9-10H,8,11H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.60 Novartis 1 » 0
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Charge States and Microspecies Visualization