pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.59999990463257	QSARToolbox	1	0	O=NN1CCCC[C@H]1c1ccc[nH+]c1,O=N[NH+]1CCCC[C@H]1c1cccnc1	O=NN1CCCC[C@H]1c1cccnc1	mol35943	O=NN1CCCC[C@H]1c1cccnc1
