Molecule ID: mol16373

SMILES: O=S(=O)(Nc1cc(Sc2cccc3cccnc23)c(O)c2ccccc12)c1ccc(F)cc1

InChI: InChI=1S/C25H17FN2O3S2/c26-17-10-12-18(13-11-17)33(30,31)28-21-15-23(25(29)20-8-2-1-7-19(20)21)32-22-9-3-5-16-6-4-14-27-24(16)22/h1-15,28-29H

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.48 Baltruschat ChEMBL 1 » 0
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Charge States and Microspecies Visualization