pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.34	AttenGpKa training set	1	0	O=C(c1ccccc1)n1cc[nH+]c1,[OH+]=C(c1ccccc1)n1ccnc1	O=C(c1ccccc1)n1ccnc1	mol25901	O=C(c1ccccc1)n1ccnc1