Molecule ID: mol18296

SMILES: CCc1ccc2c(Nc3ccc(NS(C)(=O)=O)cc3OC)c3ccccc3nc2c1

InChI: InChI=1S/C23H23N3O3S/c1-4-15-9-11-18-21(13-15)24-19-8-6-5-7-17(19)23(18)25-20-12-10-16(14-22(20)29-2)26-30(3,27)28/h5-14,26H,4H2,1-3H3,(H,24,25)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization