pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.77	Datawarrior	1	0	Cc1cc(C)c(C[NH3+])cc1N	Cc1cc(C)c(CN)cc1N	mol14140	Cc1cc(C)c(CN)cc1N
9.7700005	OCHEM	1	0	Cc1cc(C)c(C[NH3+])cc1N	Cc1cc(C)c(CN)cc1N	mol14140	Cc1cc(C)c(CN)cc1N
4.57	Datawarrior	2	1	Cc1cc(C)c(C[NH3+])cc1[NH3+]	Cc1cc(C)c(C[NH3+])cc1N	mol14140	Cc1cc(C)c(CN)cc1N