pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
13.3999996185303	QSARToolbox	0	-1	O=C1C[C@H](Sc2ccc(Cl)cc2)N1	O=C1C[C@H](Sc2ccc(Cl)cc2)[N-]1	mol34114	O=C1CC(Sc2ccc(Cl)cc2)N1
13.3599996566772	QSARToolbox	0	-1	O=C1C[C@H](Sc2ccc(Cl)cc2)N1	O=C1C[C@H](Sc2ccc(Cl)cc2)[N-]1	mol34114	O=C1CC(Sc2ccc(Cl)cc2)N1