pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.94	Baltruschat ChEMBL	1	0	COc1ccc([NH2+]c2c3ccccc3nc3ccccc23)cc1,COc1ccc(Nc2c3ccccc3[nH+]c3ccccc23)cc1	COc1ccc(Nc2c3ccccc3nc3ccccc23)cc1	mol20173	COc1ccc(Nc2c3ccccc3nc3ccccc23)cc1
