Molecule ID: mol21398

SMILES: CCCN1C(=O)CN(Cc2ccc(-c3ccc(F)c(CN4CCCCC4)n3)cc2)C1=O

InChI: InChI=1S/C24H29FN4O2/c1-2-12-29-23(30)17-28(24(29)31)15-18-6-8-19(9-7-18)21-11-10-20(25)22(26-21)16-27-13-4-3-5-14-27/h6-11H,2-5,12-17H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization