pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.5	Novartis	1	0	Fc1ccc([C@H]2CC[NH2+]C[C@@H]2COc2ccc3c(c2)OCO3)cc1	Fc1ccc([C@H]2CCNC[C@@H]2COc2ccc3c(c2)OCO3)cc1	mol2946	Fc1ccc([C@H]2CCNC[C@@H]2COc2ccc3c(c2)OCO3)cc1