pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.4	Baltruschat ChEMBL	1	0	CC(C)C(=O)N(Cc1ccccc1-c1ccccc1)[C@H]1CC[NH2+]C1	CC(C)C(=O)N(Cc1ccccc1-c1ccccc1)[C@H]1CCNC1	mol16666	CC(C)C(=O)N(Cc1ccccc1-c1ccccc1)[C@H]1CCNC1
