pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.63	Baltruschat ChEMBL	1	0	COc1ccc(Cl)cc1[NH2+]c1cc(C(F)(F)F)c(C(=O)NCC2CCOCC2)cn1,COc1ccc(Cl)cc1Nc1cc(C(F)(F)F)c(C(=O)NCC2CCOCC2)c[nH+]1	COc1ccc(Cl)cc1Nc1cc(C(F)(F)F)c(C(=O)NCC2CCOCC2)cn1	mol18366	COc1ccc(Cl)cc1Nc1cc(C(F)(F)F)c(C(=O)NCC2CCOCC2)cn1