Molecule ID: mol32055

SMILES: Cc1nccc(N2CCC(C(=O)N3CCN(S(=O)(=O)c4ccc(Br)cc4)CC3)CC2)n1

InChI: InChI=1S/C21H26BrN5O3S/c1-16-23-9-6-20(24-16)25-10-7-17(8-11-25)21(28)26-12-14-27(15-13-26)31(29,30)19-4-2-18(22)3-5-19/h2-6,9,17H,7-8,10-15H2,1H3

Experimental Macro pKa Values

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