pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.15	Baltruschat ChEMBL	1	0	Cc1ccccc1[C@@H]1CCc2c(C(=O)N(C)C)cn3c(C)c(C)[nH+]c3c2O1	Cc1ccccc1[C@@H]1CCc2c(C(=O)N(C)C)cn3c(C)c(C)nc3c2O1	mol21621	Cc1ccccc1[C@@H]1CCc2c(C(=O)N(C)C)cn3c(C)c(C)nc3c2O1