pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.15	Baltruschat ChEMBL	0	-1	COC(=O)c1nc(-c2ccncc2)[nH]c1C(=O)OC	COC(=O)c1nc(-c2ccncc2)[n-]c1C(=O)OC	mol16609	COC(=O)c1nc(-c2ccncc2)[nH]c1C(=O)OC
3.98	Baltruschat ChEMBL	1	0	COC(=O)c1[nH]c(-c2ccncc2)[nH+]c1C(=O)OC,COC(=O)c1nc(-c2cc[nH+]cc2)[nH]c1C(=O)OC	COC(=O)c1nc(-c2ccncc2)[nH]c1C(=O)OC	mol16609	COC(=O)c1nc(-c2ccncc2)[nH]c1C(=O)OC