OpenMolDB

S-6-T7

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C370	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[S-6-T7]	2.53					George W. Gokel 2003

S-7-T3

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C220	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[S-7-T3]	2.55					George W. Gokel 2003

S-7-T5

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C326	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[S-7-T5]	2.48					George W. Gokel 2003

S-7-T7

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C372	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[Heptakis(2,3,6-tri-O-Methyl)-b-Cyclodextrin](1).[S-7-T7]	2.57	1.52				George W. Gokel 2003

S-8-T3

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C222	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[S-8-T3]	2.78					George W. Gokel 2003

S-8-T5

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C328	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[S-8-T5]	2.40					George W. Gokel 2003

S-8-T7

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C374	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[EtDMe-b-CD](1).[S-8-T7]	2.98	1.79				George W. Gokel 2003

S-9-T3

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C224	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[S-9-T3]	2.88					George W. Gokel 2003

S-9-T5

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C330	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[S-9-T5]	3.00					George W. Gokel 2003

S-9-T7

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C376	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

S-Apomorphine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
267.32	3	2	2.79				SF_C184	None		Not checked

SMILES: CN1CCC2=C3[C@@H]1CC4=C(C3=CC=C2)C(=C(C=C4)O)O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[sulfobutylether-b-cyclodextrin](1).[S-Apomorphine]	0.57		3.0	25.0	Capillary electrophoresis	Ann Van Schepdael 2004
[sulfobutylether-b-cyclodextrin](2).[S-Apomorphine]	0.60		3.0	25.0	Capillary electrophoresis	Ann Van Schepdael 2004

S-C1

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C390	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[S-C1]	1.28	0.30	7.0	25.0	NMR spectroscopy	George W. Gokel 2003
[b-Cyclodextrin](1).[S-C1]	2.69	1.78	7.0	25.0	NMR spectroscopy	George W. Gokel 2003
[Hexakis(2,3,6-tri-O-Methyl)-a-Cyclodextrin](1).[S-C1]	1.57	0.60	7.0	25.0	NMR spectroscopy	George W. Gokel 2003
[Heptakis(2,3,6-tri-O-Methyl)-b-Cyclodextrin](1).[S-C1]	1.81	0.60	7.0	25.0	NMR spectroscopy	George W. Gokel 2003

S-C8

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					SF_C388	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[S-C8]	1.18	0.48	7.0	25.0	NMR spectroscopy	George W. Gokel 2003
[b-Cyclodextrin](1).[S-C8]	2.64	1.48	7.0	25.0	NMR spectroscopy	George W. Gokel 2003
[Hexakis(2,3,6-tri-O-Methyl)-a-Cyclodextrin](1).[S-C8]	1.08	0.30	7.0	25.0	NMR spectroscopy	George W. Gokel 2003
[Heptakis(2,3,6-tri-O-Methyl)-b-Cyclodextrin](1).[S-C8]	0.90	0.48	7.0	25.0	NMR spectroscopy	George W. Gokel 2003

S-Nitroso-N-acetylpenicillamine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
220.25	7	2	1.16				nt0719	None		Not checked

SMILES: CC(=O)N[C@H](C(O)=O)C(C)(C)SN=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[S-Nitroso-N-acetylpenicillamine]	1.41			25.0		Kenneth A. Connors 1995

S-Nitroso-N-acetylpenicillamine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
220.25	7	2	1.16				nt1632	None		Not checked

SMILES: CC(=O)N[C@H](C(O)=O)C(C)(C)SN=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[S-Nitroso-N-acetylpenicillamine]	2.22			25.0		Kenneth A. Connors 1995