pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.01	Datawarrior	1	0	OCCCCc1cc[nH+]cc1	OCCCCc1ccncc1	mol14241	OCCCCc1ccncc1
6.0100002	OCHEM	1	0	OCCCCc1cc[nH+]cc1	OCCCCc1ccncc1	mol14241	OCCCCc1ccncc1
6.01000022888184	QSARToolbox	1	0	OCCCCc1cc[nH+]cc1	OCCCCc1ccncc1	mol14241	OCCCCc1ccncc1