pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.23	Datawarrior	1	0	Cc1cc(C)n(-c2cc(C)[nH+][nH]2)n1,Cc1cc(-n2[nH+]c(C)cc2C)[nH]n1	Cc1cc(-n2nc(C)cc2C)[nH]n1	mol13739	Cc1cc(-n2nc(C)cc2C)[nH]n1
-2.4	Datawarrior	2	1	Cc1cc(-n2[nH+]c(C)cc2C)[nH][nH+]1	Cc1cc(C)n(-c2cc(C)[nH+][nH]2)n1,Cc1cc(-n2[nH+]c(C)cc2C)[nH]n1	mol13739	Cc1cc(-n2nc(C)cc2C)[nH]n1