pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.8	AttenGpKa training set	1	0	COc1ccc(OC)c2[nH+]c([C@H](C)O)[nH]c12	COc1ccc(OC)c2[nH]c([C@H](C)O)nc12	mol26525	COc1ccc(OC)c2[nH]c(C(C)O)nc12