pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
0.7	Datawarrior	1	0	[NH3+]c1nnnn1-c1cccc(Cl)c1,Nc1[nH+]nnn1-c1cccc(Cl)c1	Nc1nnnn1-c1cccc(Cl)c1	mol4298	Nc1nnnn1-c1cccc(Cl)c1
0.69999999	OCHEM	1	0	[NH3+]c1nnnn1-c1cccc(Cl)c1,Nc1[nH+]nnn1-c1cccc(Cl)c1	Nc1nnnn1-c1cccc(Cl)c1	mol4298	Nc1nnnn1-c1cccc(Cl)c1
0.699999988079071	QSARToolbox	1	0	[NH3+]c1nnnn1-c1cccc(Cl)c1,Nc1[nH+]nnn1-c1cccc(Cl)c1	Nc1nnnn1-c1cccc(Cl)c1	mol4298	Nc1nnnn1-c1cccc(Cl)c1