Molecule ID: mol35744

SMILES: O=C1C(N=Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)SC(=S)N1Nc1ccccc1

InChI: InChI=1S/C19H15N7O3S3/c27-17-16(31-19(30)26(17)24-14-5-2-1-3-6-14)23-22-13-7-9-15(10-8-13)32(28,29)25-18-20-11-4-12-21-18/h1-12,16,24H,(H,20,21,25)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.88 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization