pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.54	Datawarrior	1	0	CC[NH+](CC)CCCNS(=O)(=O)c1ccc(OC)c(OC)c1OC	CCN(CC)CCCNS(=O)(=O)c1ccc(OC)c(OC)c1OC	mol14617	CCN(CC)CCCNS(=O)(=O)c1ccc(OC)c(OC)c1OC