pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.56	Baltruschat ChEMBL	2	1	Cn1cc[n+](COC[n+]2ccccc2/C=N/O)c1/C=N/O	Cn1cc[n+](COC[n+]2ccccc2/C=N/[O-])c1/C=N/O,Cn1cc[n+](COC[n+]2ccccc2/C=N/O)c1/C=N/[O-]	mol18935	Cn1cc[n+](COC[n+]2ccccc2/C=N/O)c1/C=N/O