pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.5	Baltruschat ChEMBL	1	0	NC(=O)C1CC[NH+](c2c(Cl)cncc2Cl)CC1,NC(=O)C1CCN(c2c(Cl)c[nH+]cc2Cl)CC1	NC(=O)C1CCN(c2c(Cl)cncc2Cl)CC1	mol16147	NC(=O)C1CCN(c2c(Cl)cncc2Cl)CC1