OpenMolDB

sodium dodecyl sulfate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
288.38	3	0	4.46				JN_180	None		Not checked

SMILES: [Na+].CCCCCCCCCCCCO[S]([O-])(=O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

sodium dodecyl sulfonate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
272.38	2	0	4.53				JN_72	None		Not checked

SMILES: [Na+].CCCCCCCCCCCC[S]([O-])(=O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[sodium dodecyl sulfonate]	3.47	2.74		50.0	NMR spectroscopy	Hanqing Wang 1997

sodium glycocholate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
487.60	6	4	1.62				SF_C968	None		Not checked

SMILES: [Na+].CC(CCC(=O)NCC([O-])=O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[sodium glycocholate]	3.41		7.4	25.0	Isothermal titration calorimetry	Yu Liu 2005

sodium heptyl sulfate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
218.25	3	0	2.51				SF_C1746	None		Not checked

SMILES: [Na+].CCCCCCCO[S]([O-])(=O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[sodium heptyl sulfate]	2.49	1.85	7.0	25.0	NMR spectroscopy	Qing-Xiang Guo 1994

sodium hexadecyl sulfonate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
328.49	2	0	6.09				JN_73	None		Not checked

SMILES: [Na+].CCCCCCCCCCCCCCCC[S]([O-])(=O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[sodium hexadecyl sulfonate]	3.99	2.77		50.0	NMR spectroscopy	Hanqing Wang 1997

sodium hexaflouro-phosphate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C1560	None

SMILES: F[P-](F)(F)(F)(F)F.[Na+]

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[sodium hexaflouro-phosphate ]	2.16	0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[sodium hexaflouro-phosphate ]	2.01	0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

sodium hexyl sulfate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
204.22	3	0	2.12				SF_C1745	None		Not checked

SMILES: [Na+].CCCCCCO[S]([O-])(=O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[sodium hexyl sulfate]	2.16	1.57	7.0	25.0	NMR spectroscopy	Qing-Xiang Guo 1994

sodium lauroyl sarcosine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
294.39	5	1	3.45				SF_C1661	None		Not checked

SMILES: [Na].CCCCCCCCCCCC(=O)N(C)CC(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[sodium lauroyl sarcosine]	2.36	1.08	7.0	25.0	Fluorescence spectroscopy	Daniel E. Otzen 2006

sodium nonyl sulfate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
246.30	3	0	3.29				SF_C1748	None		Not checked

SMILES: [Na+].CCCCCCCCCO[S]([O-])(=O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[sodium nonyl sulfate]	3.08	2.46	7.0	25.0	NMR spectroscopy	Qing-Xiang Guo 1994

sodium octanoate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
166.19	1	0	1.10				SF_C175	None		Not checked

SMILES: [Na+].CCCCCCCC([O-])=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[sodium octanoate]	2.66	1.85	7.0	20.0	NMR spectroscopy	Gustavo González-Gaitano 2004
[b-Cyclodextrin](1).[sodium octanoate]	2.82	1.78	7.0	25.0	NMR spectroscopy	G. Tardajos 1999

sodium octanoate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
166.19	1	0	1.10				SF_C750	None		Not checked

SMILES: [Na+].CCCCCCCC([O-])=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

sodium octyl sulfate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
232.27	3	0	2.90				SF_C1747	None		Not checked

SMILES: [Na+].CCCCCCCCO[S]([O-])(=O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[sodium octyl sulfate]	2.54	1.04	7.0	25.0	NMR spectroscopy	Qing-Xiang Guo 1994

sodium octyl sulfonate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
216.27	2	0	2.97				JN_71	None		Not checked

SMILES: [Na+].CCCCCCCC[S]([O-])(=O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[sodium octyl sulfonate]	3.40	2.36		50.0	NMR spectroscopy	Hanqing Wang 1997

sodium pentyl sulfate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
190.19	3	0	1.73				SF_C1744	None		Not checked

SMILES: [Na+].CCCCCO[S]([O-])(=O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[sodium pentyl sulfate]	2.00	1.00	7.0	25.0	NMR spectroscopy	Qing-Xiang Guo 1994

sodium perchlorate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C1561	None

SMILES: [Na+].[O-][Cl](=O)(=O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[sodium perchlorate]	1.44	-0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[sodium perchlorate]	1.18	-0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002