pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.03	Datawarrior	1	0	COc1c[nH+]ccc1N,COc1cnccc1[NH3+]	COc1cnccc1N	mol13617	COc1cnccc1N
9.0299997	OCHEM	1	0	COc1c[nH+]ccc1N,COc1cnccc1[NH3+]	COc1cnccc1N	mol13617	COc1cnccc1N