pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.40999984741211	QSARToolbox	0	-1	COc1cc(C(=O)N(C)O)ccc1C	COc1cc(C(=O)N(C)[O-])ccc1C	mol31433	COc1cc(C(=O)N(C)O)ccc1C
8.41	AttenGpKa training set	0	-1	COc1cc(C(=O)N(C)O)ccc1C	COc1cc(C(=O)N(C)[O-])ccc1C	mol31433	COc1cc(C(=O)N(C)O)ccc1C