pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.83	Datawarrior	1	0	OCCCCc1cccc[nH+]1	OCCCCc1ccccn1	mol14243	OCCCCc1ccccn1
5.8299999	OCHEM	1	0	OCCCCc1cccc[nH+]1	OCCCCc1ccccn1	mol14243	OCCCCc1ccccn1
5.82999992370606	QSARToolbox	1	0	OCCCCc1cccc[nH+]1	OCCCCc1ccccn1	mol14243	OCCCCc1ccccn1