pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.69000005722046	QSARToolbox	2	1	CCc1ccc([C@@H]2CCC[NH+]2C)c[nH+]1	CCc1ccc([C@@H]2CCC[NH+]2C)cn1	mol36069	CCc1ccc([C@@H]2CCCN2C)cn1