Molecule ID: mol21397

SMILES: CC(C)CN1C(=O)CN(Cc2ccc(-c3ccc(F)c(CN4CCCCC4)n3)cc2)C1=O

InChI: InChI=1S/C25H31FN4O2/c1-18(2)14-30-24(31)17-29(25(30)32)15-19-6-8-20(9-7-19)22-11-10-21(26)23(27-22)16-28-12-4-3-5-13-28/h6-11,18H,3-5,12-17H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization