Molecule ID: mol16381

SMILES: O=S(=O)(Nc1ccccc1-c1nccc2ccccc12)c1ccc(Cl)cc1

InChI: InChI=1S/C21H15ClN2O2S/c22-16-9-11-17(12-10-16)27(25,26)24-20-8-4-3-7-19(20)21-18-6-2-1-5-15(18)13-14-23-21/h1-14,24H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization