pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.12	OCHEM	1	0	c1ccc([C@H]2C[NH+]3CCC[C@H]3c3ccccc32)cc1	c1ccc([C@H]2CN3CCC[C@H]3c3ccccc32)cc1	mol32234	c1ccc([C@H]2CN3CCC[C@H]3c3ccccc32)cc1
9.11999988555908	QSARToolbox	1	0	c1ccc([C@H]2C[NH+]3CCC[C@H]3c3ccccc32)cc1	c1ccc([C@H]2CN3CCC[C@H]3c3ccccc32)cc1	mol32234	c1ccc([C@H]2CN3CCC[C@H]3c3ccccc32)cc1