pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.6	AttenGpKa training set	0	-1	CC(=O)N[C@H](Cc1c(F)c(F)c(O)c(F)c1F)C(N)=O	CC(=O)N[C@H](Cc1c(F)c(F)c([O-])c(F)c1F)C(N)=O	mol29477	CC(=O)NC(Cc1c(F)c(F)c(O)c(F)c1F)C(N)=O