pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.7	Datawarrior	1	0	CNC(=O)/C=C(\c1ccc2nc([NH3+])n(C3CCCC3)c2c1)c1ccccc1F,CNC(=O)/C=C(\c1ccc2[nH+]c(N)n(C3CCCC3)c2c1)c1ccccc1F	CNC(=O)/C=C(\c1ccc2nc(N)n(C3CCCC3)c2c1)c1ccccc1F	mol14797	CNC(=O)/C=C(\c1ccc2nc(N)n(C3CCCC3)c2c1)c1ccccc1F
