pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.6	Datawarrior	1	0	CCC[C@H]1NC(Nc2ccc(SC)cc2)=NC(N)=[NH+]1,CCC[C@@H]1N=C(N)[NH+]=C(Nc2ccc(SC)cc2)N1	CCC[C@@H]1N=C(N)N=C(Nc2ccc(SC)cc2)N1	mol15496	CCCC1N=C(N)N=C(Nc2ccc(SC)cc2)N1