pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.8	AttenGpKa training set	1	0	[NH3+]/N=C(\c1ccccc1)c1cccs1,N/[NH+]=C(\c1ccccc1)c1cccs1	N/N=C(\c1ccccc1)c1cccs1	mol24833	N/N=C(\c1ccccc1)c1cccs1