pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.5	AttenGpKa training set	0	-1	C/[NH+]=C\c1c(CO)cnc(C)c1[O-],C/N=C\c1c(CO)c[nH+]c(C)c1[O-],C/N=C\c1c(CO)cnc(C)c1O	C/N=C\c1c(CO)cnc(C)c1[O-]	mol30609	C/N=C\c1c(CO)cnc(C)c1O