Molecule ID: mol20872

SMILES: CCc1ccc(CCOc2ccc(CC3SC(=O)NC3=O)cc2)nc1

InChI: InChI=1S/C19H20N2O3S/c1-2-13-3-6-15(20-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)21-19(23)25-17/h3-8,12,17H,2,9-11H2,1H3,(H,21,22,23)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
13.74 Baltruschat ChEMBL -1 » -2
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Charge States and Microspecies Visualization