pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1	Datawarrior	1	0	CC1(C)CC(=O)C(C)(C)[NH2+]1	CC1(C)CC(=O)C(C)(C)N1	mol13062	CC1(C)CC(=O)C(C)(C)N1
7.0999999	OCHEM	1	0	CC1(C)CC(=O)C(C)(C)[NH2+]1	CC1(C)CC(=O)C(C)(C)N1	mol13062	CC1(C)CC(=O)C(C)(C)N1