Molecule ID: mol21393

SMILES: O=C1CN(Cc2ccc(-c3ccc(F)c(CN4CCCCC4)n3)cc2)C(=O)N1CC(F)F

InChI: InChI=1S/C23H25F3N4O2/c24-18-8-9-19(27-20(18)13-28-10-2-1-3-11-28)17-6-4-16(5-7-17)12-29-15-22(31)30(23(29)32)14-21(25)26/h4-9,21H,1-3,10-15H2

Experimental Macro pKa Values

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