Molecule ID: mol20197

SMILES: CN(c1ccccc1Nc1c2ccccc2nc2ccccc12)S(C)(=O)=O

InChI: InChI=1S/C21H19N3O2S/c1-24(27(2,25)26)20-14-8-7-13-19(20)23-21-15-9-3-5-11-17(15)22-18-12-6-4-10-16(18)21/h3-14H,1-2H3,(H,22,23)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization