pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.58	AttenGpKa training set	0	-1	COc1cc(CCN)ccc1O,COc1cc(CC[NH3+])ccc1[O-]	COc1cc(CCN)ccc1[O-]	mol24274	COc1cc(CCN)ccc1O
9.54	OCHEM	1	0	COc1cc(CC[NH3+])ccc1O	COc1cc(CCN)ccc1O,COc1cc(CC[NH3+])ccc1[O-]	mol24274	COc1cc(CCN)ccc1O
9.45	AttenGpKa training set	1	0	COc1cc(CC[NH3+])ccc1O	COc1cc(CCN)ccc1O,COc1cc(CC[NH3+])ccc1[O-]	mol24274	COc1cc(CCN)ccc1O