pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.1	OCHEM	1	0	CC[C@H](C)C[NH2+]C1CCCCC1	CC[C@H](C)CNC1CCCCC1	mol33170	CCC(C)CNC1CCCCC1
11.1999998092651	QSARToolbox	1	0	CC[C@H](C)C[NH2+]C1CCCCC1	CC[C@H](C)CNC1CCCCC1	mol33170	CCC(C)CNC1CCCCC1
11.8999996185303	QSARToolbox	1	0	CC[C@H](C)C[NH2+]C1CCCCC1	CC[C@H](C)CNC1CCCCC1	mol33170	CCC(C)CNC1CCCCC1