pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.79	Datawarrior	0	-1	COc1ccccc1/C=C/C=N/O	COc1ccccc1/C=C/C=N/[O-]	mol13926	COc1ccccc1/C=C/C=N/O
10.8	AttenGpKa training set	0	-1	COc1ccccc1/C=C/C=N/O	COc1ccccc1/C=C/C=N/[O-]	mol13926	COc1ccccc1/C=C/C=N/O
