pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.05	Datawarrior	1	0	CCSC(=[NH2+])c1ccccc1	CCSC(=N)c1ccccc1	mol14201	CCSC(=N)c1ccccc1
6.0500002	OCHEM	1	0	CCSC(=[NH2+])c1ccccc1	CCSC(=N)c1ccccc1	mol14201	CCSC(=N)c1ccccc1
7.94999980926514	QSARToolbox	1	0	CCSC(=[NH2+])c1ccccc1	CCSC(=N)c1ccccc1	mol14201	CCSC(=N)c1ccccc1
6.04	AttenGpKa training set	1	0	CCSC(=[NH2+])c1ccccc1	CCSC(=N)c1ccccc1	mol14201	CCSC(=N)c1ccccc1