Molecule ID: mol19763

SMILES: Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(Br)ccc2n1CC(=O)O

InChI: InChI=1S/C22H18BrN3O3/c1-14-22(17-11-16(23)7-9-19(17)25(14)13-21(28)29)18-8-10-20(27)26(24-18)12-15-5-3-2-4-6-15/h2-11H,12-13H2,1H3,(H,28,29)

Experimental Macro pKa Values

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