Molecule ID: mol21387

SMILES: CC(C)CN1C(=O)CN(Cc2ccc(-c3cccc(CN4CCCC(F)(F)C4)n3)cc2)C1=O

InChI: InChI=1S/C25H30F2N4O2/c1-18(2)13-31-23(32)16-30(24(31)33)14-19-7-9-20(10-8-19)22-6-3-5-21(28-22)15-29-12-4-11-25(26,27)17-29/h3,5-10,18H,4,11-17H2,1-2H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.30 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization