Molecule ID: mol20762

SMILES: COc1ccc(S(=O)(=O)NCCCN2CCc3cc(OC)ccc3C2)cc1

InChI: InChI=1S/C20H26N2O4S/c1-25-18-6-8-20(9-7-18)27(23,24)21-11-3-12-22-13-10-16-14-19(26-2)5-4-17(16)15-22/h4-9,14,21H,3,10-13,15H2,1-2H3

Experimental Macro pKa Values

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