pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.6	OCHEM	1	0	Fc1ccc2c(c1)[NH+](CCCN1CCOCC1)c1cc(F)ccc1CC2,Fc1ccc2c(c1)N(CCC[NH+]1CCOCC1)c1cc(F)ccc1CC2	Fc1ccc2c(c1)N(CCCN1CCOCC1)c1cc(F)ccc1CC2	mol16994	Fc1ccc2c(c1)N(CCCN1CCOCC1)c1cc(F)ccc1CC2