pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
-2.27	AttenGpKa training set	1	0	CCCCCCCC[C@@H]1CC(c2ccccc2)=[NH+]O1	CCCCCCCC[C@@H]1CC(c2ccccc2)=NO1	mol30300	CCCCCCCCC1CC(c2ccccc2)=NO1