Molecule ID: mol21391

SMILES: CC(C)CN1C(=O)CN(Cc2ccc(-c3ccc(F)c(CN4CCCC(C)C4)n3)cc2)C1=O

InChI: InChI=1S/C26H33FN4O2/c1-18(2)13-31-25(32)17-30(26(31)33)15-20-6-8-21(9-7-20)23-11-10-22(27)24(28-23)16-29-12-4-5-19(3)14-29/h6-11,18-19H,4-5,12-17H2,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization