pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.04	Baltruschat ChEMBL	1	0	CC(C)=CCOC[n+]1ccn(C)c1/C=N/O	CC(C)=CCOC[n+]1ccn(C)c1/C=N/[O-]	mol16248	CC(C)=CCOC[n+]1ccn(C)c1/C=N/O