pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.86	Baltruschat ChEMBL	1	0	CCCCNC(=O)c1ccc(-c2ccc(-c3ccccc3)n2Cc2cccc(N)[nH+]2)cc1,CCCCNC(=O)c1ccc(-c2ccc(-c3ccccc3)n2Cc2cccc([NH3+])n2)cc1	CCCCNC(=O)c1ccc(-c2ccc(-c3ccccc3)n2Cc2cccc(N)n2)cc1	mol20027	CCCCNC(=O)c1ccc(-c2ccc(-c3ccccc3)n2Cc2cccc(N)n2)cc1