Molecule ID: mol31985

SMILES: Cc1ccc(CCOCCCS(=O)(=O)CCNCCc2ccc(O)c3nc(O)sc23)nc1

InChI: InChI=1S/C22H29N3O5S2/c1-16-3-5-18(24-15-16)8-12-30-11-2-13-32(28,29)14-10-23-9-7-17-4-6-19(26)20-21(17)31-22(27)25-20/h3-6,15,23,26H,2,7-14H2,1H3,(H,25,27)

Experimental Macro pKa Values

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