pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.9	Baltruschat ChEMBL	1	0	COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OCCC[NH+]1CCN(C)CC1,COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OCCCN1CC[NH+](C)CC1	COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OCCCN1CCN(C)CC1	mol16137	COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OCCCN1CCN(C)CC1