Molecule ID: mol21399

SMILES: CCN1C(=O)CN(Cc2ccc(-c3ccc(F)c(CN4CCCCC4)n3)cc2)C1=O

InChI: InChI=1S/C23H27FN4O2/c1-2-28-22(29)16-27(23(28)30)14-17-6-8-18(9-7-17)20-11-10-19(24)21(25-20)15-26-12-4-3-5-13-26/h6-11H,2-5,12-16H2,1H3

Experimental Macro pKa Values

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