pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.95	Baltruschat ChEMBL	1	0	Brc1ccc2c(c1)c1c3n2CC[NH+](Cc2ccccc2)[C@H]3CCC1	Brc1ccc2c(c1)c1c3n2CCN(Cc2ccccc2)[C@H]3CCC1	mol16379	Brc1ccc2c(c1)c1c3n2CCN(Cc2ccccc2)C3CCC1