pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.02	Baltruschat ChEMBL	1	0	COc1cc(C(=O)N[C@@H]2CCC[C@@H]3CC[NH+](C)C[C@@H]32)cc(OC)c1OC	COc1cc(C(=O)N[C@@H]2CCC[C@@H]3CCN(C)C[C@@H]32)cc(OC)c1OC	mol20074	COc1cc(C(=O)N[C@@H]2CCC[C@@H]3CCN(C)C[C@@H]32)cc(OC)c1OC