pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.43	Datawarrior	1	0	COCc1cccc(COC)[nH+]1	COCc1cccc(COC)n1	mol12654	COCc1cccc(COC)n1
3.4300001	OCHEM	1	0	COCc1cccc(COC)[nH+]1	COCc1cccc(COC)n1	mol12654	COCc1cccc(COC)n1
3.35999989509583	QSARToolbox	1	0	COCc1cccc(COC)[nH+]1	COCc1cccc(COC)n1	mol12654	COCc1cccc(COC)n1
