OpenMolDB

D-Xylose

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
150.13	5	4	-2.74				nt1840	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

D-alanin

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
89.09	3	2	0.12				SF_C488	None		Not checked

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

Supramolecules

Name	log K	pH	T(°C)	Method	Ref
[mono(6-phenylseleno-6-deoxy)-β-cyclodextrin](1).[D-alanin]	2.55	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono(2-phenylseleno-2-deoxy)-β-cyclodextrin](1).[D-alanin]	2.39	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[6-(p-methoxyphenylseleno)-6-deoxy]-β-cyclodextrin](1).[D-alanin]	2.10	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[2-(p-methoxyphenylseleno)-2-deoxy]-β-cyclodextrin](1).[D-alanin]	1.72	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003

D-alanine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
89.09	3	2	0.12				NT_b0134	None		Not checked

SMILES: 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).[D-alanine]	3.19	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-b-cyclodextrin](1).[D-alanine]	3.06	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-g-cyclodextrin](1).[D-alanine]	2.96	7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-anilino-6-deoxy)-b-cyclodextrin](1).[D-alanine]	3.52	7.2	25.0	Calorimetry	Yu Liu 1998

D-alanine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
89.09	3	2	0.12				JN_318	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono[6-O-(diphenoxyphosphoryl)]-b-cyclodextrin](1).[D-alanine]	2.12		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997
[mono[6-O-(ethoxyhydroxyphosphoryl)]-b-cyclodextrin](1).[D-alanine]	1.75		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997

D-cysteine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
121.16	4	3	0.03				JN_323	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono[6-O-(diphenoxyphosphoryl)]-b-cyclodextrin](1).[D-cysteine]	2.71		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997
[mono[6-O-(ethoxyhydroxyphosphoryl)]-b-cyclodextrin](1).[D-cysteine]	2.77		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997

D-leucin

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
131.17	3	2	1.14				SF_C492	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).[D-leucin]	2.47	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono(2-phenylseleno-2-deoxy)-β-cyclodextrin](1).[D-leucin]	1.38	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[6-(p-methoxyphenylseleno)-6-deoxy]-β-cyclodextrin](1).[D-leucin]	1.82	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[2-(p-methoxyphenylseleno)-2-deoxy]-β-cyclodextrin](1).[D-leucin]	1.83	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003

D-leucine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
131.17	3	2	1.14				NT_b0144	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).[D-leucine]	3.35	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-b-cyclodextrin](1).[D-leucine]	3.46	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-g-cyclodextrin](1).[D-leucine]	3.22	7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-anilino-6-deoxy)-b-cyclodextrin](1).[D-leucine]	3.67	7.2	25.0	Calorimetry	Yu Liu 1998

D-leucine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
131.17	3	2	1.14				JN_322	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono[6-O-(diphenoxyphosphoryl)]-b-cyclodextrin](1).[D-leucine]	3.23		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997
[mono[6-O-(ethoxyhydroxyphosphoryl)]-b-cyclodextrin](1).[D-leucine]	2.69		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997

D-limonene

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
136.23	0	0	3.31				NT_a0062	None		Not checked

SMILES: CC(=C)C1CCC(=CC1)C

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](2).[D-limonene]	2.43			20.0	phase solubility	Schmidt, P. C. 2003

D-phenylalanine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
165.19	3	2	1.34				VR_C87	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[D-phenylalanine]	0.90	0.78	5.01	25.0	Titration calorimetry	Robert N. Goldberg 1994

D-serin

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
105.09	4	3	-0.91				SF_C490	None		Not checked

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

Supramolecules

Name	log K	pH	T(°C)	Method	Ref
[mono(6-phenylseleno-6-deoxy)-β-cyclodextrin](1).[D-serin]	1.71	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono(2-phenylseleno-2-deoxy)-β-cyclodextrin](1).[D-serin]	1.89	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[6-(p-methoxyphenylseleno)-6-deoxy]-β-cyclodextrin](1).[D-serin]	1.66	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[2-(p-methoxyphenylseleno)-2-deoxy]-β-cyclodextrin](1).[D-serin]	1.76	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003

D-serine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
105.09	4	3	-0.91				NT_b0140	None		Not checked

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

Supramolecules

Name	log K	pH	T(°C)	Method	Ref
[mono[6-(1-pyridinio)-6-deoxy]-a-cyclodextrin](1).[D-serine]	2.92	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-b-cyclodextrin](1).[D-serine]	2.82	7.2	25.0	Calorimetry	Yu Liu 1998
[mono[6-(1-pyridinio)-6-deoxy]-g-cyclodextrin](1).[D-serine]	2.77	7.2	25.0	Calorimetry	Yu Liu 1998
[mono-(6-anilino-6-deoxy)-b-cyclodextrin](1).[D-serine]	3.43	7.2	25.0	Calorimetry	Yu Liu 1998

D-serine

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
105.09	4	3	-0.91				JN_320	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).[D-serine]	3.17		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997
[mono[6-O-(ethoxyhydroxyphosphoryl)]-b-cyclodextrin](1).[D-serine]	1.48		7.2	25.0	UV-vis spectroscopy	Yu Liu 1997

D-tryptophan

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
204.23	3	3	1.82				SF_C540	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).[D-tryptophan]	1.30	1.00	5.0	25.0	UV electronic spectroscopy	O. A. C. Antunes 2006

D-valin

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
117.15	3	2	0.75				SF_C494	None		Not checked

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

Supramolecules

Name	log K	pH	T(°C)	Method	Ref
[mono(2-phenylseleno-2-deoxy)-β-cyclodextrin](1).[D-valin]	1.56	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[6-(p-methoxyphenylseleno)-6-deoxy]-β-cyclodextrin](1).[D-valin]	1.66	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003
[mono[2-(p-methoxyphenylseleno)-2-deoxy]-β-cyclodextrin](1).[D-valin]	2.01	7.2	25.0	UV-vis spectroscopy	Yu Liu 2003