Molecule ID: mol12819

SMILES: O=C(O)c1nsc2ccccc12

InChI: InChI=1S/C8H5NO2S/c10-8(11)7-5-3-1-2-4-6(5)12-9-7/h1-4H,(H,10,11)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.76 QSARToolbox 0 » -1
2.76 QSARToolbox 0 » -1
2.76 Datawarrior 0 » -1
2.76 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization