Molecule ID: mol32533

SMILES: CC1(C)SC2C(NC(=O)Cc3ccc(O)cc3)C(=O)N2C1C(=O)O

InChI: InChI=1S/C16H18N2O5S/c1-16(2)12(15(22)23)18-13(21)11(14(18)24-16)17-10(20)7-8-3-5-9(19)6-4-8/h3-6,11-12,14,19H,7H2,1-2H3,(H,17,20)(H,22,23)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.62 OCHEM 0 » -1
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Charge States and Microspecies Visualization