pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.3	OCHEM	1	0	[O-]/N=C/c1cc[n+](Cc2ccc(C[n+]3ccc(/C=N/O)cc3)cc2)cc1	[O-]/N=C/c1cc[n+](Cc2ccc(C[n+]3ccc(/C=N/[O-])cc3)cc2)cc1	mol17958	O/N=C/c1cc[n+](Cc2ccc(C[n+]3ccc(/C=N/O)cc3)cc2)cc1
7.58	OCHEM	1	0	[O-]/N=C/c1cc[n+](Cc2ccc(C[n+]3ccc(/C=N/O)cc3)cc2)cc1	[O-]/N=C/c1cc[n+](Cc2ccc(C[n+]3ccc(/C=N/[O-])cc3)cc2)cc1	mol17958	O/N=C/c1cc[n+](Cc2ccc(C[n+]3ccc(/C=N/O)cc3)cc2)cc1