pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
12.3	AttenGpKa training set	1	0	CCc1cccc(CC)c1/[NH+]=C(\NC)N(C)C	CCc1cccc(CC)c1/N=C(\NC)N(C)C	mol28095	CCc1cccc(CC)c1/N=C(\NC)N(C)C