Molecule ID: mol32231

SMILES: Cc1cc(C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)n(-c2ccc3onc(N)c3c2)n1

InChI: InChI=1S/C24H20N6O4S/c1-14-12-20(30(28-14)17-10-11-21-19(13-17)23(25)29-34-21)24(31)27-16-8-6-15(7-9-16)18-4-2-3-5-22(18)35(26,32)33/h2-13H,1H3,(H2,25,29)(H,27,31)(H2,26,32,33)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.30 OCHEM 1 » 0
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Charge States and Microspecies Visualization