pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.15	Datawarrior	0	-1	On1nnc2ccc(Cl)cc21	[O-]n1nnc2ccc(Cl)cc21	mol14039	On1nnc2ccc(Cl)cc21
4.1500001	OCHEM	0	-1	On1nnc2ccc(Cl)cc21	[O-]n1nnc2ccc(Cl)cc21	mol14039	On1nnc2ccc(Cl)cc21
4.15000009536743	QSARToolbox	0	-1	On1nnc2ccc(Cl)cc21	[O-]n1nnc2ccc(Cl)cc21	mol14039	On1nnc2ccc(Cl)cc21