OpenMolDB

(R)-2-Amino-propionic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
89.09	3	2	0.12				NT_a0040	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[6-(m-toluidinyl)-6-deoxy-b-cyclodextrin].[(R)-2-Amino-propionic acid]	3.16		7.2	20.0	N.A.	Liu, Yu; Yoshihisa Inoue 1998

(R)-2-phenylbutyric acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
164.20	2	1	2.26				SF_C1574	None		Not checked

SMILES: CC[C@@H](C(O)=O)c1ccccc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[(R)-2-phenylbutyric acid]	2.35	0.48	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[(R)-2-phenylbutyric acid]	1.97	0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-3-bromo-2-methyl-1-propanol

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
153.02	1	1	1.01				SF_C1596	None		Not checked

SMILES: C[C@H](CO)CBr

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[(R)-3-bromo-2-methyl-1-propanol ]	2.06	0.78	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[(R)-3-bromo-2-methyl-1-propanol ]	2.15	0.60	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-3-phenylbutyric acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
164.20	2	1	2.26				SF_C1576	None		Not checked

SMILES: C[C@H](CC(O)=O)c1ccccc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[(R)-3-phenylbutyric acid ]	2.63	1.18	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[(R)-3-phenylbutyric acid ]	2.60	0.60	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-a-methoxy-a-trifluoromethylphenylacetic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
234.17	3	1	2.18				SF_C1558	None		Not checked

SMILES: O=C(O)[C@](OC)(C1=CC=CC=C1)C(F)(F)F

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[(R)-a-methoxy-a-trifluoromethylphenylacetic acid ]	2.75	1.00	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[(R)-a-methoxy-a-trifluoromethylphenylacetic acid ]	2.24	0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-a-methoxyphenylacetic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
166.17	3	1	1.46				SF_C1592	None		Not checked

SMILES: O=C(O)[C@@H](C1=CC=CC=C1)OC

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[(R)-a-methoxyphenylacetic acid]	1.52	0.48	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[(R)-a-methoxyphenylacetic acid]	1.04	0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-camphanic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
182.26	2	1	2.53				SF_C1525	None		Not checked

SMILES: CC1(C)C2CC[C@]1(C)C(C2)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[(R)-camphanic acid]	2.25	0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-camphanic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
182.26	2	1	2.53				SF_C1552	None		Not checked

SMILES: CC1(C)C2CC[C@]1(C)C(C2)C(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[(R)-camphanic acid ]	2.24	0.48	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[(R)-camphanic acid ]	2.25	0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-camphor sulfonic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
232.30	4	1	2.35				SF_C1526	None		Not checked

SMILES: CC1(C)C2CC[C@]1(C[S](O)(=O)=O)C(=O)C2

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[(R)-camphor sulfonic acid ]	2.75	1.00	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-hexahydromandelic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
158.19	3	2	1.01				SF_C1539	None		Not checked

SMILES: C1CCC(CC1)[C@H](C(=O)O)O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[(R)-hexahydromandelic acid]	2.81	1.08	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-hexahydromandelic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
158.19	3	2	1.01				SF_C1588	None		Not checked

SMILES: C1CCC(CC1)[C@H](C(=O)O)O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[(R)-hexahydromandelic acid]	3.36	1.70	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-mandelic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
152.15	3	2	0.80				SF_C1541	None		Not checked

SMILES: O[C@@H](C(O)=O)c1ccccc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[(R)-mandelic acid ]	1.74	0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-mandelic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
152.15	3	2	0.80				SF_C1590	None		Not checked

SMILES: O[C@@H](C(O)=O)c1ccccc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[(R)-mandelic acid ]	1.04	0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-mandelic acid methyl ester

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
166.17	3	1	0.89				SF_C1601	None		Not checked

SMILES: COC(=O)[C@@H](C1=CC=CC=C1)O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[(R)-mandelic acid methyl ester]	1.62	0.70	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[(R)-mandelic acid methyl ester]	1.83	0.30	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002

(R)-phenyllactic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
166.17	3	2	0.98				SF_C1578	None		Not checked

SMILES: C[C@](O)(C(O)=O)c1ccccc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[mono-(6-amino-6-deoxy)-b-CD](1).[(R)-phenyllactic acid ]	2.40	0.48	6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[(R)-phenyllactic acid ]	1.94		6.9	25.0	Titration Calorimetry	Yoshihisa Inoue 2002