pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1	OCHEM	1	0	COc1ccccc1N1CCN(CCC[NH2+]c2cc(=O)n(C)c(=O)n2C)CC1,COc1ccccc1N1CC[NH+](CCCNc2cc(=O)n(C)c(=O)n2C)CC1,COc1ccccc1[NH+]1CCN(CCCNc2cc(=O)n(C)c(=O)n2C)CC1	COc1ccccc1N1CCN(CCCNc2cc(=O)n(C)c(=O)n2C)CC1	mol17519	COc1ccccc1N1CCN(CCCNc2cc(=O)n(C)c(=O)n2C)CC1