pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.18	Baltruschat ChEMBL	1	0	CC(C)NC(=O)NCCc1ccc(OC[C@@H](O)C[NH2+]C(C)C)cc1	CC(C)NC[C@H](O)COc1ccc(CCNC(=O)NC(C)C)cc1	mol17896	CC(C)NCC(O)COc1ccc(CCNC(=O)NC(C)C)cc1