Molecule ID: mol21392

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

InChI: InChI=1S/C26H34N4O2/c1-19(2)14-30-25(31)18-29(26(30)32)16-21-9-11-22(12-10-21)24-8-4-7-23(27-24)17-28-13-5-6-20(3)15-28/h4,7-12,19-20H,5-6,13-18H2,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization