pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.7	Baltruschat ChEMBL	1	0	CC(C)(C)NC[C@H](O)c1cc(Cl)c([NH3+])c(C(F)(F)F)c1,CC(C)(C)[NH2+]C[C@H](O)c1cc(Cl)c(N)c(C(F)(F)F)c1	CC(C)(C)NC[C@H](O)c1cc(Cl)c(N)c(C(F)(F)F)c1	mol17460	CC(C)(C)NCC(O)c1cc(Cl)c(N)c(C(F)(F)F)c1