Sulfanilamide
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
172.20 4 2 2.28 nt1773 None Not checked

SMILES: Nc1ccc(cc1)[S](N)(=O)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[Sulfanilamide] 2.54 25.0 Kenneth A. Connors 1995

Sulfanilamide
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
172.20 4 2 2.28 nt1774 None Not checked

SMILES: Nc1ccc(cc1)[S](N)(=O)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef

Sulfapyridine
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
249.29 5 2 3.20 nt1769 None Not checked

SMILES: Nc1ccc(cc1)[S](=O)(=O)Nc2ccccn2

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[Sulfapyridine] 2.66 25.0 Kenneth A. Connors 1995

Sulfapyridine
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
249.29 5 2 3.20 nt1770 None Not checked

SMILES: Nc1ccc(cc1)[S](=O)(=O)Nc2ccccn2

Supramolecules

Namelog KSDpHT(°C)MethodRef

Sulfapyridine
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
249.29 5 2 3.20 nt1776 None Not checked

SMILES: Nc1ccc(cc1)[S](=O)(=O)Nc2ccccn2

Supramolecules

Namelog KSDpHT(°C)MethodRef

Sulfapyridine
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
249.29 5 2 3.20 nt1777 None Not checked

SMILES: Nc1ccc(cc1)[S](=O)(=O)Nc2ccccn2

Supramolecules

Namelog KSDpHT(°C)MethodRef

Sulfated-a-Cyclodextrin
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None CY-1045 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[Sulfated-a-Cyclodextrin](1).[R-(-)-] 3.53 1.90 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-a-Cyclodextrin](1).[S-(+)-] 3.53 1.90 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-a-Cyclodextrin](1).[R-(-)-3-amino-2-(4-chlorophenyl)propylphosphonic acid] 2.34 1.18 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-a-Cyclodextrin](1).[S-(+)-3-amino-2-(4-chlorophenyl)propylphosphonic acid] 2.30 1.00 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-a-Cyclodextrin](1).[R-(-)-3-amino-2-(4-chlorophenyl)propylsulfonic acid] 2.02 1.15 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-a-Cyclodextrin](1).[S-(+)-3-amino-2-(4-chlorophenyl)propylsulfonic acid] 2.00 1.00 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-a-Cyclodextrin](1).[S-(+)-3-amino-2-(4-chlorophenyl)-2-hydroxy-propylsulfonic acid] 2.01 0.95 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-a-Cyclodextrin](1).[R-(-)-3-amino-2-(4-chlorophenyl)-2-hydroxy-propylsulfonic acid] 2.01 0.95 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-a-Cyclodextrin](1).[pyridine ] 1.88 1.20 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[3-methyl-pyridine] 1.82 0.96 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[hydrogen sulfide] 0.05 -0.85 22.0 HS-GCMS Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[methanethiol] -0.12 -0.89 22.0 HS-GCMS Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[dimethyl sulfide] -0.43 -1.22 22.0 HS-GCMS Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[phenyl acetate] 0.81 -0.22 8.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[phenyl acetate] 0.66 0.26 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[m-cresol] 0.51 0.38 8.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[m-cresol] 0.63 0.57 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[phenol ] 0.64 0.40 8.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[phenol ] 1.03 0.60 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[indole] 1.18 0.15 8.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[indole] 1.38 1.30 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[skatole] 1.19 0.79 8.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[skatole] 1.14 0.72 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[arginine] 2.08 1.28 9.4 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[arginine] 1.94 1.26 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[lysine] 2.22 1.09 9.4 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[lysine] 2.01 1.08 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[ornithine] 2.14 0.68 9.4 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[ornithine] 2.26 1.17 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[citrulline] 2.37 1.39 9.4 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[citrulline] 2.35 1.99 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[cysteine] 1.61 1.25 9.4 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006

Sulfated-b-Cyclodextrin
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None CY-2045 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[Sulfated-b-Cyclodextrin](1).[Costa-type complex (R=n-C6H13)] 4.48 25.0 1H-NMR Hui-Lan Chen 2003
[Sulfated-b-Cyclodextrin](1).[terbutaline] 3.17 UV Apryll M. Stalcup 1998
[Sulfated-b-Cyclodextrin](1).[terbutaline] 3.24 1.70 3.0 20.0 capillary electrophoresis Apryll M. Stalcup 1998
[Sulfated-b-Cyclodextrin](1).[chiral N-imidazole derivative 1 (R enantiomer)] 2.56 31.0 NMR spectroscopy Claude Vaccher 2006
[Sulfated-b-Cyclodextrin](1).[chiral N-imidazole derivative 1 (S enantiomer)] 2.41 32.0 NMR spectroscopy Claude Vaccher 2006
[Sulfated-b-Cyclodextrin](1).[R-(-)-] 3.20 1.51 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-b-Cyclodextrin](1).[S-(+)-] 3.17 1.60 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-b-Cyclodextrin](1).[R-(-)-3-amino-2-(4-chlorophenyl)propylphosphonic acid] 2.24 0.95 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-b-Cyclodextrin](1).[S-(+)-3-amino-2-(4-chlorophenyl)propylphosphonic acid] 2.23 1.00 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-b-Cyclodextrin](1).[R-(-)-3-amino-2-(4-chlorophenyl)propylsulfonic acid] 2.17 1.08 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-b-Cyclodextrin](1).[S-(+)-3-amino-2-(4-chlorophenyl)propylsulfonic acid] 2.18 1.04 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-b-Cyclodextrin](1).[S-(+)-3-amino-2-(4-chlorophenyl)-2-hydroxy-propylsulfonic acid] 2.06 1.00 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-b-Cyclodextrin](1).[R-(-)-3-amino-2-(4-chlorophenyl)-2-hydroxy-propylsulfonic acid] 2.13 1.11 2.5 25.0 Capillary electrophoresis Claude Vaccher 2005
[Sulfated-b-Cyclodextrin](1).[butyric acid] 0.32 0.18 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[isobutyric acid] 0.40 0.15 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[valeric acid] 1.12 0.43 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[isovaleric acid] 0.72 0.08 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[lactic acid] 0.56 0.04 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[succinic acid] 1.65 0.88 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[cadaverine] 1.98 0.99 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[putrescine] 1.91 0.83 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[pyridine ] 0.54 -1.00 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[pyridine ] 2.28 1.03 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[3-methyl-pyridine] 0.59 -0.52 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[3-methyl-pyridine] 2.42 1.07 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[diphenylamine] 1.52 0.46 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[hydrogen sulfide] -0.06 -1.15 22.0 HS-GCMS Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[methanethiol] -0.74 -1.22 22.0 HS-GCMS Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[dimethyl sulfide] -0.37 -1.52 22.0 HS-GCMS Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[phenyl acetate] 0.41 -0.70 8.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[phenyl acetate] 0.78 0.56 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[m-cresol] 0.77 -0.10 8.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[m-cresol] 1.25 0.94 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[phenol ] 0.88 -0.15 8.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[phenol ] 1.23 0.96 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[indole] 1.19 0.46 8.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[indole] 1.66 1.32 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[skatole] 1.28 8.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[skatole] 1.35 0.60 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[dodecanol] 0.91 0.34 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[tatradecanol] 1.16 0.52 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[arginine] 2.51 1.97 9.4 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[arginine] 2.18 1.03 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[lysine] 2.15 1.14 9.4 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[lysine] 2.24 0.49 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[ornithine] 2.28 1.34 9.4 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[ornithine] 2.57 1.39 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[citrulline] 3.03 1.76 9.4 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[citrulline] 2.37 1.39 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[cysteine] 2.86 1.58 9.4 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[cysteine] 2.40 1.69 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[ammonia] 1.29 0.68 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[methylamine] 1.14 0.58 7.0 22.0 NMR titration Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[tryptophan] 1.69 0.69 4.5 22.0 affinity capillary electrophoresis Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[L-Phe-L-Phe] 2.51 Capillary electrophoresis Bezhan Chankvetadze 2004
[Sulfated-b-Cyclodextrin](1).[L-Phe-L-Phe] 2.51 1.56 2.5 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[L-Phe-L-Phe] 1.57 0.85 5.3 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[D-Phe-D-Phe] 2.51 Capillary electrophoresis Bezhan Chankvetadze 2004
[Sulfated-b-Cyclodextrin](1).[D-Phe-D-Phe] 2.51 1.57 2.5 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[D-Phe-D-Phe] 1.54 0.85 5.3 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[L-Ala-L-Tyr] 2.65 Capillary electrophoresis Bezhan Chankvetadze 2004
[Sulfated-b-Cyclodextrin](1).[L-Ala-L-Tyr] 2.65 1.74 2.5 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[L-Ala-L-Tyr] 1.60 0.85 5.3 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[D-Ala-D-Tyr] 2.65 Capillary electrophoresis Bezhan Chankvetadze 2004
[Sulfated-b-Cyclodextrin](1).[D-Ala-D-Tyr] 2.65 1.73 2.5 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[D-Ala-D-Tyr] 1.63 0.90 5.3 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[L-Asp-L-PheOMe] 2.71 Capillary electrophoresis Bezhan Chankvetadze 2004
[Sulfated-b-Cyclodextrin](1).[L-Asp-L-PheOMe] 2.71 1.69 2.5 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[L-Asp-L-PheOMe] 1.48 0.85 5.3 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[D-Asp-D-PheOMe] 2.72 Capillary electrophoresis Bezhan Chankvetadze 2004
[Sulfated-b-Cyclodextrin](1).[D-Asp-D-PheOMe] 2.72 1.68 2.5 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[D-Asp-D-PheOMe] 1.60 0.90 5.3 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[L-Phe-L-Ala] 2.40 Capillary electrophoresis Bezhan Chankvetadze 2004
[Sulfated-b-Cyclodextrin](1).[L-Phe-L-Ala] 2.40 1.46 2.5 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[L-Phe-L-Ala] 1.65 0.45 5.3 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[D-Phe-D-Ala] 2.40 Capillary electrophoresis Bezhan Chankvetadze 2004
[Sulfated-b-Cyclodextrin](1).[D-Phe-D-Ala] 2.40 1.43 2.5 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[D-Phe-D-Ala] 1.65 0.59 5.3 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[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
[Sulfated-b-Cyclodextrin](1).[norepinephrine] 3.01 2.54 7.4 25.0 Microchip-affinity capillary electrophoresis Maria A. Schwarz 2005
[Sulfated-b-Cyclodextrin](1).[norepinephrine] 3.19 7.4 25.0 Affinity capillary electrophoresis Maria A. Schwarz 2005
[Sulfated-b-Cyclodextrin](1).[L-epinephrine] 2.95 2.31 7.4 25.0 Microchip-affinity capillary electrophoresis Maria A. Schwarz 2005
[Sulfated-b-Cyclodextrin](1).[L-epinephrine] 3.27 7.4 25.0 Affinity capillary electrophoresis Maria A. Schwarz 2005
[Sulfated-b-Cyclodextrin](1).[L-epinephrine] 3.62 6.0 25.0 Microchip-affinity capillary electrophoresis Maria A. Schwarz 2005
[Sulfated-b-Cyclodextrin](1).[L-epinephrine] 3.27 8.0 25.0 Microchip-affinity capillary electrophoresis Maria A. Schwarz 2005
[Sulfated-b-Cyclodextrin](1).[L-epinephrine] 3.43 9.0 25.0 Microchip-affinity capillary electrophoresis Maria A. Schwarz 2005
[Sulfated-b-Cyclodextrin](1).[L-Ala-L-Phe] 1.58 0.85 5.3 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[D-Ala-D-Phe] 1.61 0.85 5.3 20.0 Capillary electrophoresis Gerhard K. E. Scriba 2003
[Sulfated-b-Cyclodextrin](1).[phenyladamantyl-modified MPEG] 2.64 1.58 7.0 25.0 Affinity capillary electrophoresis Carole Karakasyan 2004

T-3912
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
363.41 5 2 3.83 JN_Z_1 None Not checked

SMILES: CC1=CC(=CN=C1NC)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)C

Supramolecules

Namelog KSDpHT(°C)MethodRef
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[T-3912] 3.98 7.5 25.0 HPLC Tetsumi Yamakawa 2003