pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.17	Datawarrior	1	0	OCCC[C@H]1CC[C@@H]2CCC[NH+]12	OCCC[C@H]1CC[C@@H]2CCCN12	mol12826	OCCC[C@H]1CC[C@@H]2CCCN12