pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.7	AttenGpKa training set	1	0	COCN(COC)c1nc(N(COC)COC)nc([NH+](COC)COC)n1,COCN(COC)c1nc(N(COC)COC)[nH+]c(N(COC)COC)n1	COCN(COC)c1nc(N(COC)COC)nc(N(COC)COC)n1	mol25856	COCN(COC)c1nc(N(COC)COC)nc(N(COC)COC)n1