Molecule ID: mol20935

SMILES: N#Cc1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c(C(=O)O)c1

InChI: InChI=1S/C19H17N3O6S/c20-12-13-1-6-17(16(11-13)19(24)25)21-18(23)14-2-4-15(5-3-14)29(26,27)22-7-9-28-10-8-22/h1-6,11H,7-10H2,(H,21,23)(H,24,25)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization