pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.0	Baltruschat ChEMBL	0	-1	CCCN[C@H]1CCc2nc(N)sc2C1	CCCN[C@H]1CCc2nc([NH-])sc2C1	mol17489	CCCNC1CCc2nc(N)sc2C1