pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.0	Datawarrior	1	0	C1C[NH2+]CCSCCN1	C1CNCCSCCN1	mol13602	C1CNCCSCCN1
4.16	Datawarrior	2	1	C1C[NH2+]CCSCC[NH2+]1	C1C[NH2+]CCSCCN1	mol13602	C1CNCCSCCN1