pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.4	AttenGpKa training set	1	0	Cc1ccc(C)c([NH2+]O)c1	Cc1ccc(C)c(NO)c1	mol24741	Cc1ccc(C)c(NO)c1
