Molecule ID: mol20140

SMILES: CC(C)c1cc(C(=O)N2Cc3ccc(OCCCN4CCOCC4)cc3C2)c(O)cc1O

InChI: InChI=1S/C25H32N2O5/c1-17(2)21-13-22(24(29)14-23(21)28)25(30)27-15-18-4-5-20(12-19(18)16-27)32-9-3-6-26-7-10-31-11-8-26/h4-5,12-14,17,28-29H,3,6-11,15-16H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization