OpenMolDB

L-phenylalanineamide+

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					VR_C88	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[L-phenylalanineamide+]	1.08	0.04	5.01	25.0	Titration calorimetry	Robert N. Goldberg 1994
[b-Cyclodextrin](1).[L-phenylalanineamide+]	1.34	0.30	5.01	25.0	Titration calorimetry	Robert N. Goldberg 1994

L-phenylalanineamide0

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					VR_C89	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[L-phenylalanineamide0]	1.27	0.36	10.02	25.0	Titration calorimetry	Robert N. Goldberg 1994
[b-Cyclodextrin](1).[L-phenylalanineamide0]	2.03	0.48	10.02	25.0	Titration calorimetry	Robert N. Goldberg 1994

L-proline

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
115.13	3	2	0.15				NT_b0138	None		Not checked

SMILES: OC(=O)[C@@H]1CCCN1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono[6-(1-pyridinio)-6-deoxy]-a-cyclodextrin](1).[L-proline]	3.34		7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-b-cyclodextrin](1).[L-proline]	3.08		7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-g-cyclodextrin](1).[L-proline]	3.06		7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-anilino-6-deoxy)-b-cyclodextrin](1).[L-proline]	3.64		7.2	25.0	Calorimetry	Yu Liu 1998

L-proline

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
115.13	3	2	0.15				JN_324	None		Not checked

SMILES: OC(=O)[C@@H]1CCCN1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono[6-O-(diphenoxyphosphoryl)]-b-cyclodextrin](1).[L-proline]	2.82		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997

L-serin

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
105.09	4	3	-0.91				SF_C489	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono(6-phenylseleno-6-deoxy)-β-cyclodextrin](1).[L-serin]	2.00		7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono(2-phenylseleno-2-deoxy)-β-cyclodextrin](1).[L-serin]	2.44		7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[6-(p-methoxyphenylseleno)-6-deoxy]-β-cyclodextrin](1).[L-serin]	2.07		7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[2-(p-methoxyphenylseleno)-2-deoxy]-β-cyclodextrin](1).[L-serin]	2.43		7.2	25.0	UV-vis spectroscopy	Yu Liu 2003

L-serine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
105.09	4	3	-0.91				NT_b0139	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono[6-(1-pyridinio)-6-deoxy]-a-cyclodextrin](1).[L-serine]	3.15		7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-b-cyclodextrin](1).[L-serine]	3.07		7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-g-cyclodextrin](1).[L-serine]	3.00		7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-anilino-6-deoxy)-b-cyclodextrin](1).[L-serine]	3.49		7.2	25.0	Calorimetry	Yu Liu 1998

L-serine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
105.09	4	3	-0.91				JN_319	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono[6-O-(diphenoxyphosphoryl)]-b-cyclodextrin](1).[L-serine]	2.61		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997
[mono[6-O-(ethoxyhydroxyphosphoryl)]-b-cyclodextrin](1).[L-serine]	2.09		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997

L-tris(1,10-phenanthroline) Rh(III) complex

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					VR_C41	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[per-CO2-b-CD](1).[L-tris(1,10-phenanthroline) Rh(III) complex]	3.18	1.78	7.0	25.0	1H NMR titration	Koji Kano 2001

L-tris(1,10-phenanthroline) Ru(II) complex

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					VR_C40	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[per-CO2-b-CD](1).[L-tris(1,10-phenanthroline) Ru(II) complex]	3.10	1.70	7.0	25.0	1H NMR titration	Koji Kano 2001

L-tryptophan

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
204.23	3	3	1.82				NT_b0122	None		Not checked

SMILES: N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[L-tryptophan]	1.79	0.03	7.2	25.0	Calorimetry	Yu Liu 1998
[a-Cyclodextrin](1).[L-tryptophan]	2.01	1.06	8.0	18.0	UV-vis spectroscopy	Andrzej Temeriusz 2006
[a-Cyclodextrin](1).[L-tryptophan]	4.28		7.0	25.0	microcalorimetry	Giuseppina Castronuovo 1995
[a-Cyclodextrin](1).[L-tryptophan]	4.45		11.3	25.0	microcalorimetry	Giuseppina Castronuovo 1995
[b-Cyclodextrin](1).[L-tryptophan]	3.26	0.04	7.2	25.0	Calorimetry	Yu Liu 1998
[b-Cyclodextrin](1).[L-tryptophan]	2.61	2.39	8.0	18.0	UV-vis spectroscopy	Andrzej Temeriusz 2006
[g-Cyclodextrin](1).[L-tryptophan]	1.95	0.07	7.2	25.0	Calorimetry	Yu Liu 1998
[g-Cyclodextrin](1).[L-tryptophan]	2.29	1.34	8.0	18.0	UV-vis spectroscopy	Andrzej Temeriusz 2006
[mono[6-(1-pyridinio)-6-deoxy]-a-cyclodextrin](1).[L-tryptophan]	2.39	0.05	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-b-cyclodextrin](1).[L-tryptophan]	3.71	0.03	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-g-cyclodextrin](1).[L-tryptophan]	2.22	0.01	7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-O-diphenylphosphoro)-b-cyclodextrin](1).[L-tryptophan]	1.98	0.08	7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-O-ethoxyhydroxyphosphoro)-b-cyclodextrin](1).[L-tryptophan]	3.36	0.06	7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-phenylseleno-6-deoxy)-b-cyclodextrin](1).[L-tryptophan]	2.07	0.03	7.2	25.0	Calorimetry	Yu Liu 1998
[mono-[6-[(p-tolyl)seleno]-6-deoxy)-b-cyclodextrin](1).[L-tryptophan]	2.24	0.04	7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-benzylseleno-6-deoxy)-b-cyclodextrin](1).[L-tryptophan]	2.02	0.02	7.2	25.0	Calorimetry	Yu Liu 1998

L-tryptophan

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
204.23	3	3	1.82				SF_C180	None		Not checked

SMILES: N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[Hexakis(2,3,6-tri-O-Methyl)-a-Cyclodextrin](1).[L-tryptophan]	2.53	1.63	8.0	18.0	UV-vis spectroscopy	Andrzej Temeriusz 2006
[Heptakis(2,3,6-tri-O-Methyl)-b-Cyclodextrin](1).[L-tryptophan]	2.93	2.35	8.0	18.0	UV-vis spectroscopy	Andrzej Temeriusz 2006
[Octakis(2,3,6-tri-O-Methyl)-g-Cyclodextrin](1).[L-tryptophan]	2.77	2.02	8.0	18.0	UV-vis spectroscopy	Andrzej Temeriusz 2006

L-tryptophan

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
204.23	3	3	1.82				SF_C541	None		Not checked

SMILES: N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[L-tryptophan]	-0.05	-0.70	5.0	25.0	UV electronic spectroscopy	O. A. C. Antunes 2006

L-tryptophan

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
204.23	3	3	1.82				JN_12	None		Not checked

SMILES: N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

L-tryptophane

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
204.23	3	3	1.82				JN_253	None		Not checked

SMILES: N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[L-tryptophane]	1.44	-0.22			freezing point depression method, osmotic measurements	Masahiko Suzuki 1993
[b-Cyclodextrin](1).[L-tryptophane]	1.35	-0.10	9.88	25.0	displacement of a fluorescent probe	Oswald S.Tee 1996
[b-Cyclodextrin](1).[L-tryptophane]	2.35				freezing point depression method, osmotic measurements	Masahiko Suzuki 1993
[g-Cyclodextrin](1).[L-tryptophane]	1.17	0.04			freezing point depression method, osmotic measurements	Masahiko Suzuki 1993

L-tyrosine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
181.19	4	3	1.05				JN_10	None		Not checked

SMILES: N[C@@H](Cc1ccc(O)cc1)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[L-tyrosine]	5.17		11.3	25.0	microcalorimetry	Giuseppina Castronuovo 1995
[b-Cyclodextrin](1).[L-tyrosine]	1.25	0.51	9.88	25.0	displacement of a fluorescent probe	Oswald S.Tee 1996