Molecule ID: mol16419

SMILES: CC1([N+](C)(C)C)CN(c2c(F)cc3c(=O)c(C(=O)O)cn(C4CC4)c3c2F)C1

InChI: InChI=1S/C20H23F2N3O3/c1-20(25(2,3)4)9-23(10-20)17-14(21)7-12-16(15(17)22)24(11-5-6-11)8-13(18(12)26)19(27)28/h7-8,11H,5-6,9-10H2,1-4H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization