pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.91	OCHEM	1	0	C[C@H]1CC[C@@H]2CCCC[C@H]2[NH2+]1	C[C@H]1CC[C@@H]2CCCC[C@H]2N1	mol2201	C[C@H]1CC[C@@H]2CCCC[C@H]2N1