pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.79	IUPAC digitized pKa	0	-1	O=C(C(=S)N(CCCO)CCCO)N(CCCO)CCCO	O=C(C(=S)N(CCC[O-])CCCO)N(CCCO)CCCO,O=C(C(=S)N(CCCO)CCCO)N(CCC[O-])CCCO	mol12010	O=C(C(=S)N(CCCO)CCCO)N(CCCO)CCCO
11.67	IUPAC digitized pKa	0	-1	O=C(C(=S)N(CCCO)CCCO)N(CCCO)CCCO	O=C(C(=S)N(CCC[O-])CCCO)N(CCCO)CCCO,O=C(C(=S)N(CCCO)CCCO)N(CCC[O-])CCCO	mol12010	O=C(C(=S)N(CCCO)CCCO)N(CCCO)CCCO