pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.45	AttenGpKa training set	0	-1	O=C(c1ccc2[nH]c(=O)oc2c1)c1cc(F)ccc1F	O=C(c1ccc2[n-]c(=O)oc2c1)c1cc(F)ccc1F	mol30310	O=C1Nc2ccc(C(=O)c3cc(F)ccc3F)cc2O1