pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.99	Baltruschat ChEMBL	1	0	CC/C=C/CCOC[n+]1ccn(C)c1/C=N/O	CC/C=C/CCOC[n+]1ccn(C)c1/C=N/[O-]	mol21482	CC/C=C/CCOC[n+]1ccn(C)c1/C=N/O