pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.94	Novartis	0	-1	O=c1[nH]c(-c2ccc(C(F)(F)F)cc2)nc2c1CSCC2	O=c1[n-]c(-c2ccc(C(F)(F)F)cc2)nc2c1CSCC2	mol3022	O=c1[nH]c(-c2ccc(C(F)(F)F)cc2)nc2c1CSCC2
