pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1	Baltruschat ChEMBL	1	0	C/N=C(\NC#N)NCCSCc1csc([NH+]=C(N)N)n1,C/[NH+]=C(\NC#N)NCCSCc1csc(N=C(N)N)n1,C/N=C(\NC#N)NCCSCc1csc(N=C(N)N)[nH+]1	C/N=C(\NC#N)NCCSCc1csc(N=C(N)N)n1	mol21666	C/N=C(\NC#N)NCCSCc1csc(N=C(N)N)n1