pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.25	QSARToolbox	4	3	CN(C)C(=O)C[NH+]1CC[NH+](CC(=O)N(C)C)CC[NH+](CC(=[OH+])N(C)C)CC1	CN(C)C(=O)C[NH+]1CCN(CC(=[OH+])N(C)C)CC[NH+](CC(=O)N(C)C)CC1,CN(C)C(=O)C[NH+]1CC[NH+](CC(=O)N(C)C)CC[NH+](CC(=O)N(C)C)CC1	mol36076	CN(C)C(=O)CN1CCN(CC(=O)N(C)C)CCN(CC(=O)N(C)C)CC1