pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.59	Baltruschat ChEMBL	1	0	COc1cc([NH3+])c(Cl)cc1C(=O)NC1CCN(Cc2ccccc2)CC1,COc1cc(N)c(Cl)cc1C(=O)NC1CC[NH+](Cc2ccccc2)CC1	COc1cc(N)c(Cl)cc1C(=O)NC1CCN(Cc2ccccc2)CC1	mol16566	COc1cc(N)c(Cl)cc1C(=O)NC1CCN(Cc2ccccc2)CC1