Molecule ID: mol16813

SMILES: O=C(Cc1cccc2ccccc12)N[C@H](Cc1cc2ccc(F)cc2[nH]1)C(=O)O

InChI: InChI=1S/C23H19FN2O3/c24-17-9-8-16-10-18(25-20(16)12-17)13-21(23(28)29)26-22(27)11-15-6-3-5-14-4-1-2-7-19(14)15/h1-10,12,21,25H,11,13H2,(H,26,27)(H,28,29)/t21-/m1/s1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization