OpenMolDB

L-isoleucine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
131.17	3	2	1.14				NT_b0137	None		Not checked

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

Supramolecules

Name	log K	pH	T(°C)	Method	Ref
[mono[6-(1-pyridinio)-6-deoxy]-a-cyclodextrin](1).[L-isoleucine]	3.72	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-b-cyclodextrin](1).[L-isoleucine]	3.90	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-g-cyclodextrin](1).[L-isoleucine]	3.65	7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-anilino-6-deoxy)-b-cyclodextrin](1).[L-isoleucine]	3.79	7.2	25.0	Calorimetry	Yu Liu 1998

L-isoleucine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
131.17	3	2	1.14				JN_315	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[L-isoleucine]	0.92	-0.30			freezing point depression method, osmotic measurements	Masahiko Suzuki 1993
[mono[6-O-(diphenoxyphosphoryl)]-b-cyclodextrin](1).[L-isoleucine]	2.82		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997

L-leucin

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
131.17	3	2	1.14				SF_C491	None		Not checked

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

Supramolecules

Name	log K	pH	T(°C)	Method	Ref
[mono(6-phenylseleno-6-deoxy)-β-cyclodextrin](1).[L-leucin]	2.46	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono(2-phenylseleno-2-deoxy)-β-cyclodextrin](1).[L-leucin]	2.30	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[6-(p-methoxyphenylseleno)-6-deoxy]-β-cyclodextrin](1).[L-leucin]	2.52	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[2-(p-methoxyphenylseleno)-2-deoxy]-β-cyclodextrin](1).[L-leucin]	1.77	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003

L-leucine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
131.17	3	2	1.14				NT_b0143	None		Not checked

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

Supramolecules

Name	log K	pH	T(°C)	Method	Ref
[mono[6-(1-pyridinio)-6-deoxy]-a-cyclodextrin](1).[L-leucine]	3.60	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-b-cyclodextrin](1).[L-leucine]	3.69	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-g-cyclodextrin](1).[L-leucine]	3.50	7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-anilino-6-deoxy)-b-cyclodextrin](1).[L-leucine]	3.70	7.2	25.0	Calorimetry	Yu Liu 1998

L-leucine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
131.17	3	2	1.14				JN_251	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[L-leucine]	0.94	-0.30			freezing point depression method, osmotic measurements	Masahiko Suzuki 1993
[b-Cyclodextrin](1).[L-leucine]	0.97	-0.36	9.88	25.0	displacement of a fluorescent probe	Oswald S.Tee 1996
[mono[6-O-(diphenoxyphosphoryl)]-b-cyclodextrin](1).[L-leucine]	3.15		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997
[mono[6-O-(ethoxyhydroxyphosphoryl)]-b-cyclodextrin](1).[L-leucine]	2.58		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997

L-lysine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
146.19	4	3	0.93				NT_b0145	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono[6-(1-pyridinio)-6-deoxy]-b-cyclodextrin](1).[L-lysine]	2.31		7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-anilino-6-deoxy)-b-cyclodextrin](1).[L-lysine]	2.57		7.2	25.0	Calorimetry	Yu Liu 1998

L-metanephrine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
197.23	4	3	1.04				SF_C642	None		Not checked

SMILES: CNCC(O)c1ccc(O)c(OC)c1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[Sulfated-b-Cyclodextrin](1).[L-metanephrine]	3.35	2.16	7.4	25.0	Microchip-affinity capillary electrophoresis	Maria A. Schwarz 2005
[Sulfated-b-Cyclodextrin](1).[L-metanephrine]	3.61		7.4	25.0	Affinity capillary electrophoresis	Maria A. Schwarz 2005

L-methionine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
149.21	4	2	0.85				NT_b0146	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono[6-(1-pyridinio)-6-deoxy]-b-cyclodextrin](1).[L-methionine]	2.52		7.2	25.0	Calorimetry	Yu Liu 1998

L-methionine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
149.21	4	2	0.85				JN_316	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[L-methionine]	1.24	-0.52			freezing point depression method, osmotic measurements	Masahiko Suzuki 1993
[b-Cyclodextrin](1).[L-methionine]	0.18	0.11			freezing point depression method, osmotic measurements	Masahiko Suzuki 1993
[mono[6-O-(diphenoxyphosphoryl)]-b-cyclodextrin](1).[L-methionine]	2.80		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997

L-phenylalanine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
165.19	3	2	1.34				SF_C852	None		Not checked

SMILES: N[C@@H](Cc1ccccc1)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[L-phenylalanine]	5.65	5.00	7.0	25.0	UV-vis spectroscopy	Margarita Valero 2003
[b-Cyclodextrin](1).[L-phenylalanine]	0.48	0.85	5.01	25.0	Titration calorimetry	Robert N. Goldberg 1994
[b-Cyclodextrin](1).[L-phenylalanine]	4.26		7.0	25.0	microcalorimetry	Giuseppina Castronuovo 1995
[b-Cyclodextrin](1).[L-phenylalanine]	5.03		11.3	25.0	microcalorimetry	Giuseppina Castronuovo 1995
[b-Cyclodextrin](1).[L-phenylalanine]	1.70	0.73	9.88	25.0	displacement of a fluorescent probe	Oswald S.Tee 1996
[b-Cyclodextrin](1).[L-phenylalanine]	1.34	1.00			freezing point depression method, osmotic measurements	Masahiko Suzuki 1993
[a-Cyclodextrin](1).[L-phenylalanine]	1.16	-0.40	7.8	17.0	NMR spectroscopy	Reinhard Wimmer 2002
[a-Cyclodextrin](1).[L-phenylalanine]	1.18		7.0		Calorimetry	Reinhard Wimmer 2002
[a-Cyclodextrin](1).[L-phenylalanine]	0.90	0.48	13.6		Calorimetry	Reinhard Wimmer 2002
[a-Cyclodextrin](1).[L-phenylalanine]	1.40		11.3		Calorimetry	Reinhard Wimmer 2002
[a-Cyclodextrin](1).[L-phenylalanine]	1.20	0.04	11.0		Spectral inhibition titration	Reinhard Wimmer 2002
[a-Cyclodextrin](1).[L-phenylalanine]	1.19	-0.70	11.0		Calorimetry	Reinhard Wimmer 2002
[a-Cyclodextrin](1).[L-phenylalanine]	1.63		7.2		Calorimetry	Reinhard Wimmer 2002
[a-Cyclodextrin](1).[L-phenylalanine]	0.90	0.70	5.0		Calorimetry	Reinhard Wimmer 2002
[a-Cyclodextrin](1).[L-phenylalanine]	1.00		7.0		Diffusion followed by Gouey-interferometry	Reinhard Wimmer 2002
[a-Cyclodextrin](1).[L-phenylalanine]	0.90	0.70	5.01	25.0	Titration calorimetry	Robert N. Goldberg 1994
[a-Cyclodextrin](1).[L-phenylalanine]	4.18		7.0	25.0	microcalorimetry	Giuseppina Castronuovo 1995
[a-Cyclodextrin](1).[L-phenylalanine]	4.40		11.3	25.0	microcalorimetry	Giuseppina Castronuovo 1995
[a-Cyclodextrin](1).[L-phenylalanine]	3.90		13.6	25.0	microcalorimetry	Giuseppina Castronuovo 1995
[a-Cyclodextrin](1).[L-phenylalanine]	1.21	0.30			freezing point depression method, osmotic measurements	Masahiko Suzuki 1993

L-phenylalanine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
165.19	3	2	1.34				VR_C86	None		Not checked

SMILES: N[C@@H](Cc1ccccc1)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

L-phenylalanine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
165.19	3	2	1.34				JN_9	None		Not checked

SMILES: N[C@@H](Cc1ccccc1)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

L-phenylalanine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
165.19	3	2	1.34				JN_255	None		Not checked

SMILES: N[C@@H](Cc1ccccc1)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[g-Cyclodextrin](1).[L-phenylalanine]	0.18	-0.52			freezing point depression method, osmotic measurements	Masahiko Suzuki 1993

L-phenylalanine amide

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
164.20	3	2	1.44				SF_C1090	None		Not checked

SMILES: N[C@@H](Cc1ccccc1)C(N)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[L-phenylalanine amide]	2.00		10.0	25.0	Microcalorimetry	Yoshihisa Inoue 2000

L-phenylalanine methyl ester

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
179.22	3	1	1.43				SF_C1092	None		Not checked

SMILES: COC(=O)[C@@H](N)Cc1ccccc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[L-phenylalanine methyl ester ]	1.04	0.30	4.8	25.0	Microcalorimetry	Yoshihisa Inoue 2000