6A-N-dansylpermethylated-ß-cyclodextrin (Dan-NH-TMCD)
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None VD-0031 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[6A-N-dansylpermethylated-ß-cyclodextrin (Dan-NH-TMCD)](2).[meso-tetra(4-carboxyphenyl)porphyrin] 16.60 UV-Vis spectroscopy John T. Groves 2004
[6A-N-dansylpermethylated-ß-cyclodextrin (Dan-NH-TMCD)](2).[meso-tetra(4-carboxyphenyl)porphyrin] 16.15 fluorescence titration John T. Groves 2004
[6A-N-dansylpermethylated-ß-cyclodextrin (Dan-NH-TMCD)](2).[manganese(III)tetrakis(2,3,5,6-tetrafluoro-N,N,N-trimethyl-4-aniliniumyl) porphyrin] 9.79 UV-Vis spectroscopy John T. Groves 2004
[6A-N-dansylpermethylated-ß-cyclodextrin (Dan-NH-TMCD)](2).[manganese(III) tetrakis(4-sulfonatophenyl) porphyrin ] 10.85 UV-Vis spectroscopy John T. Groves 2004
[6A-N-dansylpermethylated-ß-cyclodextrin (Dan-NH-TMCD)](2).[manganese(III) tetrakis(4-carboxyphenyl) porphyrin ] 11.20 UV-Vis spectroscopy John T. Groves 2004

6I-(N-deoxy-b-cyclodextrin-6I-yl)-1-amido-3-substituted-7-pyridin-4-yl indolizine derivatives
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None VD-0004 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[6I-(N-deoxy-b-cyclodextrin-6I-yl)-1-amido-3-substituted-7-pyridin-4-yl indolizine derivatives](1).[1-adamantanol] 5.32 7.0 25.0 Fluorescence spectroscopy Franc¸ois Delattre 2005
[6I-(N-deoxy-b-cyclodextrin-6I-yl)-1-amido-3-substituted-7-pyridin-4-yl indolizine derivatives](1).[1-adamantanoic acid] 3.86 7.0 25.0 Fluorescence spectroscopy Franc¸ois Delattre 2005
[6I-(N-deoxy-b-cyclodextrin-6I-yl)-1-amido-3-substituted-7-pyridin-4-yl indolizine derivatives](1).[chlorbenzene] 3.13 7.0 25.0 Fluorescence spectroscopy Franc¸ois Delattre 2005
[6I-(N-deoxy-b-cyclodextrin-6I-yl)-1-amido-3-substituted-7-pyridin-4-yl indolizine derivatives](1).[brombenzene] 3.16 7.0 25.0 Fluorescence spectroscopy Franc¸ois Delattre 2005
[6I-(N-deoxy-b-cyclodextrin-6I-yl)-1-amido-3-substituted-7-pyridin-4-yl indolizine derivatives](1).[toluene] 2.79 7.0 25.0 Fluorescence spectroscopy Franc¸ois Delattre 2005
[6I-(N-deoxy-b-cyclodextrin-6I-yl)-1-amido-3-substituted-7-pyridin-4-yl indolizine derivatives](1).[propylbenzene] 3.36 7.0 25.0 Fluorescence spectroscopy Franc¸ois Delattre 2005
[6I-(N-deoxy-b-cyclodextrin-6I-yl)-1-amido-3-substituted-7-pyridin-4-yl indolizine derivatives](1).[1,1,2-trichloroethane] 4.10 7.0 25.0 Fluorescence spectroscopy Franc¸ois Delattre 2005

6a-methyl prednisolone
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
374.47 8 3 1.80 JN_261 None Not checked

SMILES: O=C1C=C[C@]2(C)[C@@]3([H])C(O)C[C@]4(C)[C@](C(CO)=O)(O)CC[C@@]4([H])[C@]3([H])C[C@H](C)C2=C1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[6a-methyl prednisolone] 1.99 0.48 5.5 25.0 NMR spectroscopy Kim L.Larsen 2005
[b-Cyclodextrin](1).[6a-methyl prednisolone] 3.01 1.48 5.5 25.0 NMR spectroscopy Kim L.Larsen 2005
[g-Cyclodextrin](1).[6a-methyl prednisolone] 3.40 1.98 5.5 25.0 NMR spectroscopy Kim L.Larsen 2005
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[6a-methyl prednisolone] 2.76 1.20 5.5 25.0 NMR spectroscopy Kim L.Larsen 2005
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[6a-methyl prednisolone] 2.75 25.0 UV-vis spectroscopy Kim L.Larsen 2005
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[6a-methyl prednisolone] 2.79 25.0 Kim L.Larsen 2005
[6-O-R-maltosyl-b-CD](1).[6a-methyl prednisolone] 3.11 1.61 5.5 25.0 NMR spectroscopy Kim L.Larsen 2005
[sulfobutylether-b-cyclodextrin](1).[6a-methyl prednisolone] 2.85 1.28 5.5 25.0 NMR spectroscopy Kim L.Larsen 2005
[sulfobutylether-b-cyclodextrin](1).[6a-methyl prednisolone] 2.86 25.0 Kim L.Larsen 2005
[sulfobutylether-b-cyclodextrin](1).[6a-methyl prednisolone] 2.86 25.0 UV-vis spectroscopy Kim L.Larsen 2005
[sulfobutylether-g-cyclodextrin](1).[6a-methyl prednisolone] 3.10 1.59 5.5 25.0 NMR spectroscopy Kim L.Larsen 2005
[sulfobutylether-g-cyclodextrin](1).[6a-methyl prednisolone] 3.12 25.0 Kim L.Larsen 2005

7-hydroxyquinoline
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
145.16 2 1 1.94 SF_C594 None Not checked

SMILES: Oc1ccc2cccnc2c1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[7-hydroxyquinoline] 1.94 7.0 25.0 UV-vis spectroscopy Du-Jeon Jang 2005

7-hydroxyquinoline
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
145.16 2 1 1.94 SF_C595 None Not checked

SMILES: Oc1ccc2cccnc2c1

Supramolecules

Namelog KSDpHT(°C)MethodRef

7-methoxycoumarin
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
176.17 2 0 1.80 NT_a0064 None Not checked

SMILES: COc1ccc2C=CC(=O)Oc2c1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[7-methoxycoumarin] 2.11 1.51 fluorescence suppression Wagner, Brian D. 2003
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin].[7-methoxycoumarin] 2.08 1.30 fluorescence suppression Wagner, Brian D. 2003
[g-Cyclodextrin].[7-methoxycoumarin] 1.61 0.90 fluorescence suppression Wagner, Brian D. 2003
[2-O-(2-Hydroxy)propyl-g-Cyclodextrin].[7-methoxycoumarin] 1.62 0.78 fluorescence suppression Wagner, Brian D. 2003

8-Amino-octanoic acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
159.23 3 2 2.07 JN_14 None Not checked

SMILES: NCCCCCCCC(O)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[8-Amino-octanoic acid] 4.88 3.48 7.1 25.0 microcalorimetry Giuseppina Castronuovo 1995

8-anilino-1-naphthalene sodium sulphonate
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
322.33 3 2 4.27 JN_65 None Not checked

SMILES: [Na+]C1=C2C(NC3=CC=CC=C3)=CC=CC2=CC=C1.O=S([O-])=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[8-anilino-1-naphthalene sodium sulphonate] 1.95 1.11 7.0 25.0 fluorescence emission spectroscopy Emilio Aicart 1997

8-anilinonaphthalenesulfonate
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
298.34 3 1 4.64 SF_C802 None Not checked

SMILES: [O-][S](=O)(=O)c1cccc2cccc(Nc3ccccc3)c12

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[8-anilinonaphthalenesulfonate] 2.01 7.2 25.0 Fluorescence spectroscopy Yu Liu 2001
[6,6'-o-phenylenediseleno-bridged bis(b-cyclodextrin)](1).[8-anilinonaphthalenesulfonate] 3.11 7.2 25.0 Fluorescence spectroscopy Yu Liu 2001

8-methoxypsoralen
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
216.19 2 0 2.55 SF_C1213 None Not checked

SMILES: COc1c2occc2cc3C=CC(=O)Oc13

Supramolecules

Namelog KSDpHT(°C)MethodRef
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[8-methoxypsoralen] 1.47 5.0 HPLC-method Yves Guillaume 2003
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[8-methoxypsoralen] 1.27 25.0 HPLC-method Yves Guillaume 2003

9-methyl anthracenoate
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
235.26 1 0 2.66 NT_c0252 None Not checked

SMILES: O=C([O-])C1=C2C(C)=C3C=CC=CC3=CC2=CC=C1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[9-methyl anthracenoate] 2.70 2.28 5.0 steady-state fluorescence measurement Francisco Mendicuti 1999
[b-Cyclodextrin](1).[9-methyl anthracenoate] 2.53 1.48 15.0 steady-state fluorescence measurement Francisco Mendicuti 1999
[b-Cyclodextrin](1).[9-methyl anthracenoate] 2.27 2.00 25.0 steady-state fluorescence measurement Francisco Mendicuti 1999
[b-Cyclodextrin](1).[9-methyl anthracenoate] 2.40 0.95 35.0 steady-state fluorescence measurement Francisco Mendicuti 1999
[b-Cyclodextrin](1).[9-methyl anthracenoate] 2.23 0.95 45.0 steady-state fluorescence measurement Francisco Mendicuti 1999