Molecule ID: mol544

SMILES: Cc1ccc(S(=O)(=O)Nc2c(C(=O)N[C@@H](C)C(C)(C)C)c(C)nn2C(C)(C)C)cc1

InChI: InChI=1S/C22H34N4O3S/c1-14-10-12-17(13-11-14)30(28,29)25-19-18(15(2)24-26(19)22(7,8)9)20(27)23-16(3)21(4,5)6/h10-13,16,25H,1-9H3,(H,23,27)/t16-/m0/s1

Experimental Macro pKa Values

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