Molecule ID: mol2781

SMILES: CC(=O)Nc1cccc2c1c(Sc1ccc(Cl)cc1)c(C)n2CC(=O)O

InChI: InChI=1S/C19H17ClN2O3S/c1-11-19(26-14-8-6-13(20)7-9-14)18-15(21-12(2)23)4-3-5-16(18)22(11)10-17(24)25/h3-9H,10H2,1-2H3,(H,21,23)(H,24,25)

Experimental Macro pKa Values

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