Molecule ID: mol20772

SMILES: Cc1ccc(NS(=O)(=O)Cc2ccccc2)c(=O)n1CC(=O)NCC1CCc2ncncc2C1

InChI: InChI=1S/C24H27N5O4S/c1-17-7-9-22(28-34(32,33)15-18-5-3-2-4-6-18)24(31)29(17)14-23(30)26-12-19-8-10-21-20(11-19)13-25-16-27-21/h2-7,9,13,16,19,28H,8,10-12,14-15H2,1H3,(H,26,30)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.40 Baltruschat ChEMBL 1 » 0
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Charge States and Microspecies Visualization