pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.2	Datawarrior	1	0	c1ccc(NCC[NH+]2CCCCC2)cc1	c1ccc(NCCN2CCCCC2)cc1	mol15705	c1ccc(NCCN2CCCCC2)cc1
9.1999998	OCHEM	1	0	c1ccc(NCC[NH+]2CCCCC2)cc1	c1ccc(NCCN2CCCCC2)cc1	mol15705	c1ccc(NCCN2CCCCC2)cc1
2.8	Datawarrior	2	1	c1ccc([NH2+]CC[NH+]2CCCCC2)cc1	c1ccc(NCC[NH+]2CCCCC2)cc1	mol15705	c1ccc(NCCN2CCCCC2)cc1