pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.0	QSARToolbox	1	0	CCCCOc1c2cc(N)cc1Cc1cc(N)cc(c1OCCCC)Cc1cc([NH3+])cc(c1OCCCC)Cc1cc(N)cc(c1OCCCC)C2	CCCCOc1c2cc(N)cc1Cc1cc(N)cc(c1OCCCC)Cc1cc(N)cc(c1OCCCC)Cc1cc(N)cc(c1OCCCC)C2	mol38467	CCCCOc1c2cc(N)cc1Cc1cc(N)cc(c1OCCCC)Cc1cc(N)cc(c1OCCCC)Cc1cc(N)cc(c1OCCCC)C2