pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.8	OCHEM	0	-1	C[C@H]1CC[C@@H]2[C@@H](C)CC[C@H](C(=O)[O-])[NH+]2C1	C[C@H]1CC[C@@H]2[C@@H](C)CC[C@H](C(=O)[O-])N2C1	mol32520	CC1CCC2C(C)CCC(C(=O)O)N2C1
2.0	OCHEM	1	0	C[C@H]1CC[C@@H]2[C@@H](C)CC[C@H](C(=O)O)[NH+]2C1	C[C@H]1CC[C@@H]2[C@@H](C)CC[C@H](C(=O)[O-])[NH+]2C1	mol32520	CC1CCC2C(C)CCC(C(=O)O)N2C1