pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.2	Novartis	1	0	COc1ccc(-c2nc([NH2+]c3ccc(F)cc3F)c3ccccc3n2)cc1OC,COc1ccc(-c2nc3ccccc3c(Nc3ccc(F)cc3F)[nH+]2)cc1OC,COc1ccc(-c2nc(Nc3ccc(F)cc3F)c3ccccc3[nH+]2)cc1OC	COc1ccc(-c2nc(Nc3ccc(F)cc3F)c3ccccc3n2)cc1OC	mol2849	COc1ccc(-c2nc(Nc3ccc(F)cc3F)c3ccccc3n2)cc1OC
