Molecule ID: mol12280

SMILES: Cc1cc(C)nc(NS(=O)(=O)c2ccc(N=Nc3ccc(O)c4ncccc34)cc2)n1

InChI: InChI=1S/C21H18N6O3S/c1-13-12-14(2)24-21(23-13)27-31(29,30)16-7-5-15(6-8-16)25-26-18-9-10-19(28)20-17(18)4-3-11-22-20/h3-12,28H,1-2H3,(H,23,24,27)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.15 IUPAC digitized pKa 0 » -1
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Charge States and Microspecies Visualization