Molecule ID: mol19188

SMILES: CC(C)N1CCC(Oc2cc3[nH]c(C(=O)N4CCOCC4)cc3cc2F)CC1

InChI: InChI=1S/C21H28FN3O3/c1-14(2)24-5-3-16(4-6-24)28-20-13-18-15(11-17(20)22)12-19(23-18)21(26)25-7-9-27-10-8-25/h11-14,16,23H,3-10H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization