Molecule ID: mol17211

SMILES: CC(C)(N)CNC(=O)CC1CCC2(CC1)COC1(OO2)C2CC3CC(C2)CC1C3

InChI: InChI=1S/C23H38N2O4/c1-21(2,24)13-25-20(26)12-15-3-5-22(6-4-15)14-27-23(29-28-22)18-8-16-7-17(10-18)11-19(23)9-16/h15-19H,3-14,24H2,1-2H3,(H,25,26)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization