Molecule ID: mol18927

SMILES: CC(=N)N1C2CC(OC(=O)C(CO)c3ccccc3)CC1C1OC12

InChI: InChI=1S/C18H22N2O4/c1-10(19)20-14-7-12(8-15(20)17-16(14)24-17)23-18(22)13(9-21)11-5-3-2-4-6-11/h2-6,12-17,19,21H,7-9H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization