Molecule ID: mol34264

SMILES: O=C1CN2CCOC2(c2ccccc2F)c2cc(Br)ccc2N1

InChI: InChI=1S/C17H14BrFN2O2/c18-11-5-6-15-13(9-11)17(12-3-1-2-4-14(12)19)21(7-8-23-17)10-16(22)20-15/h1-6,9H,7-8,10H2,(H,20,22)

Experimental Macro pKa Values

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