Molecule ID: mol21527

SMILES: CC(C)Oc1ccc(C(=O)c2ccc3n2CCC3C(=O)O)cc1

InChI: InChI=1S/C18H19NO4/c1-11(2)23-13-5-3-12(4-6-13)17(20)16-8-7-15-14(18(21)22)9-10-19(15)16/h3-8,11,14H,9-10H2,1-2H3,(H,21,22)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization