pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.3	Hunt	1	0	C[NH+]1CCO[C@@H](c2ccccc2)c2ccccc2C1	CN1CCO[C@@H](c2ccccc2)c2ccccc2C1	mol2301	CN1CCO[C@@H](c2ccccc2)c2ccccc2C1
8.5	Jensen	1	0	C[NH+]1CCO[C@@H](c2ccccc2)c2ccccc2C1	CN1CCO[C@@H](c2ccccc2)c2ccccc2C1	mol2301	CN1CCO[C@@H](c2ccccc2)c2ccccc2C1