pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.35	IUPAC digitized pKa	1	0	c1csc([C@@H]2CCC[NH2+]2)c1	c1csc([C@@H]2CCCN2)c1	mol3892	c1csc(C2CCCN2)c1
9.3500004	OCHEM	1	0	c1csc([C@@H]2CCC[NH2+]2)c1	c1csc([C@@H]2CCCN2)c1	mol3892	c1csc(C2CCCN2)c1
