pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.74	OCHEM	1	0	CNC(=O)c1cn2c(C)c(C)[nH+]c2c2c1CC[C@@H](c1ccccc1)O2	CNC(=O)c1cn2c(C)c(C)nc2c2c1CC[C@@H](c1ccccc1)O2	mol18165	CNC(=O)c1cn2c(C)c(C)nc2c2c1CCC(c1ccccc1)O2