pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.61	OCHEM	1	0	Cc1cn2c3c(=O)n(C)c(=O)n(C)c3nc2n1CCC[NH+]1CCN(c2cccc(Cl)c2Cl)CC1	Cc1cn2c3c(=O)n(C)c(=O)n(C)c3nc2n1CCCN1CCN(c2cccc(Cl)c2Cl)CC1	mol19635	Cc1cn2c3c(=O)n(C)c(=O)n(C)c3nc2n1CCCN1CCN(c2cccc(Cl)c2Cl)CC1