Molecule ID: mol20185

SMILES: CS(=O)(=O)Nc1ccccc1Nc1c2ccccc2nc2ccccc12

InChI: InChI=1S/C20H17N3O2S/c1-26(24,25)23-19-13-7-6-12-18(19)22-20-14-8-2-4-10-16(14)21-17-11-5-3-9-15(17)20/h2-13,23H,1H3,(H,21,22)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization