pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.34	Baltruschat ChEMBL	1	0	CCCCCCCCc1noc(/C(=N/O)SCC[NH+](CC)CC)n1	CCCCCCCCc1noc(/C(=N/O)SCCN(CC)CC)n1,CCCCCCCCc1noc(/C(=N/[O-])SCC[NH+](CC)CC)n1	mol20096	CCCCCCCCc1noc(/C(=N/O)SCCN(CC)CC)n1