pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.29	Organic Oxygen Acids and Nitrogen Bases	1	0	c1ccc(C2([NH+]3CCCCC3)CCCCC2)cc1	c1ccc(C2(N3CCCCC3)CCCCC2)cc1	mol17632	c1ccc(C2(N3CCCCC3)CCCCC2)cc1
9.97	Baltruschat ChEMBL	1	0	c1ccc(C2([NH+]3CCCCC3)CCCCC2)cc1	c1ccc(C2(N3CCCCC3)CCCCC2)cc1	mol17632	c1ccc(C2(N3CCCCC3)CCCCC2)cc1