Molecule ID: mol19199

SMILES: O=C1C(NC2CCCC2)=C(NS(=O)(=O)c2ccccc2)C(=O)c2ccccc21

InChI: InChI=1S/C21H20N2O4S/c24-20-16-12-6-7-13-17(16)21(25)19(18(20)22-14-8-4-5-9-14)23-28(26,27)15-10-2-1-3-11-15/h1-3,6-7,10-14,22-23H,4-5,8-9H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.10 OCHEM 0 » -1
10.10 Baltruschat ChEMBL 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization