pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.85	OCHEM	1	0	C[NH2+][C@H]1CCCC[C@H]1Cl	CN[C@H]1CCCC[C@H]1Cl	mol3293	CNC1CCCCC1Cl
9.85000038146973	QSARToolbox	1	0	C[NH2+][C@H]1CCCC[C@H]1Cl	CN[C@H]1CCCC[C@H]1Cl	mol3293	CNC1CCCCC1Cl