pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.5	Baltruschat ChEMBL	1	0	CCOC(=O)N1CC[NH+](Cc2nnc(-c3cc(Cl)ccc3F)o2)CC1	CCOC(=O)N1CCN(Cc2nnc(-c3cc(Cl)ccc3F)o2)CC1	mol21424	CCOC(=O)N1CCN(Cc2nnc(-c3cc(Cl)ccc3F)o2)CC1