Molecule ID: mol21448

SMILES: COc1ccc(N(Cc2nnn[nH]2)Cc2ccc(F)cc2F)cc1

InChI: InChI=1S/C16H15F2N5O/c1-24-14-6-4-13(5-7-14)23(10-16-19-21-22-20-16)9-11-2-3-12(17)8-15(11)18/h2-8H,9-10H2,1H3,(H,19,20,21,22)

Experimental Macro pKa Values

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