pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.0	Baltruschat ChEMBL	1	0	OCc1c(C(F)(F)F)[nH+]c2c(OCc3ccccc3)cccn12	OCc1c(C(F)(F)F)nc2c(OCc3ccccc3)cccn12	mol18013	OCc1c(C(F)(F)F)nc2c(OCc3ccccc3)cccn12