pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1	Datawarrior	1	0	Cc1cc(C)c(CO)c(C)[nH+]1	Cc1cc(C)c(CO)c(C)n1	mol14249	Cc1cc(C)c(CO)c(C)n1
7.0999999	OCHEM	1	0	Cc1cc(C)c(CO)c(C)[nH+]1	Cc1cc(C)c(CO)c(C)n1	mol14249	Cc1cc(C)c(CO)c(C)n1
