pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.44	Baltruschat ChEMBL	1	0	COc1cccc(N2CC[NH+](CCCCNC(=O)c3ccc4nonc4c3)CC2)c1	COc1cccc(N2CCN(CCCCNC(=O)c3ccc4nonc4c3)CC2)c1	mol17533	COc1cccc(N2CCN(CCCCNC(=O)c3ccc4nonc4c3)CC2)c1