pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.61	AttenGpKa training set	-1	-2	C[C@H]1CCCC(=N/[O-])/C1=N\O,C[C@H]1CCCC(=N/O)/C1=N\[O-]	C[C@H]1CCCC(=N/[O-])/C1=N\[O-]	mol31551	CC1CCCC(=N/O)/C1=N\O