tryptophan
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
204.23 3 3 1.82 JN_U_2 None Not checked

SMILES: N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef

tyramine

MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
137.18 2 2 1.59 SF_C1534 None Not checked

SMILES: NCCc1ccc(O)cc1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[tyramine ] 1.85 0.30 6.9 25.0 Titration Calorimetry Yoshihisa Inoue 2002

tyramine hydrochloride
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
173.64 2 3 2.40 SF_C1244 None Not checked

SMILES: Cl.NCCc1ccc(O)cc1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[tyramine hydrochloride] 1.65 1.04 6.0 20.0 Fluorescence spectroscopy Wieslaw Wiczk 2005

tyrosine
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
181.19 4 3 1.05 SF_C1238 None Not checked

SMILES: N[C@@H](Cc1ccc(O)cc1)C(O)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[tyrosine] 1.70 0.60 6.0 20.0 Fluorescence spectroscopy Wieslaw Wiczk 2005

tyrosine
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
181.19 4 3 1.05 JN_78 None Not checked

SMILES: N[C@@H](Cc1ccc(O)cc1)C(O)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[ammonium-containing modified BCD](1).[tyrosine] 1.60 1.00 7.0 25.0 fluorescence spectroscopy Paul J. Smith 1998
[modified BCD der. 8](1).[tyrosine] 1.48 0.48 7.0 25.0 fluorescence spectroscopy Paul J. Smith 1998

undecanedioic acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
216.27 4 2 2.67 SF_C1430 None Not checked

SMILES: OC(=O)CCCCCCCCCC(O)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[undecanedioic acid] 2.93 1.23 11.3 25.0 Calorimetry Giuseppina Castronuovo 1998

undecanoic acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
186.29 2 1 3.60 JN_36 None Not checked

SMILES: CCCCCCCCCCC(O)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[undecanoic acid] 5.93 4.23 11.3 25.0 calorimetry Giuseppina Castronuovo 1996

unique helical macromolecule consisting of a chromophoric polyacetylene backbone and a b-cyclodextrin as the side group
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None VD-0095 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[unique helical macromolecule consisting of a chromophoric polyacetylene backbone and a b-cyclodextrin as the side group](1).[1-adamantanol] 2.39 25.0 Absorpton and circular dichroism spectroscopies Eiji Yashima 2006
[unique helical macromolecule consisting of a chromophoric polyacetylene backbone and a b-cyclodextrin as the side group](1).[(-)-borneol] 1.83 25.0 Absorpton and circular dichroism spectroscopies Eiji Yashima 2006
[unique helical macromolecule consisting of a chromophoric polyacetylene backbone and a b-cyclodextrin as the side group](1).[cyclooctanol] 1.23 25.0 Absorpton and circular dichroism spectroscopies Eiji Yashima 2006
[unique helical macromolecule consisting of a chromophoric polyacetylene backbone and a b-cyclodextrin as the side group](1).[cyclohexanol] 0.48 25.0 Absorpton and circular dichroism spectroscopies Eiji Yashima 2006

unique helical macromolecule consisting of a chromophoric polyacetylene backbone and a g-cyclodextrin as the side group
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None VD-0096 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[unique helical macromolecule consisting of a chromophoric polyacetylene backbone and a g-cyclodextrin as the side group](1).[cyclododecanone] 2.48 25.0 Absorpton and circular dichroism spectroscopies Eiji Yashima 2006
[unique helical macromolecule consisting of a chromophoric polyacetylene backbone and a g-cyclodextrin as the side group](1).[cyclodecanone] 2.40 25.0 Absorpton and circular dichroism spectroscopies Eiji Yashima 2006
[unique helical macromolecule consisting of a chromophoric polyacetylene backbone and a g-cyclodextrin as the side group](1).[cyclododecanol] 2.00 25.0 Absorpton and circular dichroism spectroscopies Eiji Yashima 2006

ursodeoxycholic acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
392.57 4 3 4.48 NT_a0022 None Not checked

SMILES: C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[ursodeoxycholic acid] 4.97 8.3 25.0 Absorption spectroscopy Ueno, Akihiko 1997

ursodeoxycholic acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
392.57 4 3 4.48 SF_C1167 None Not checked

SMILES: C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[ursodeoxycholic acid] 3.55 7.4 24.0 HPLC-method G. Puglisi 1997
[b-Cyclodextrin](1).[ursodeoxycholic acid] 3.12 7.4 37.0 HPLC-method G. Puglisi 1997
[b-Cyclodextrin](1).[ursodeoxycholic acid] 2.66 7.4 45.0 HPLC-method G. Puglisi 1997
[b-Cyclodextrin](1).[ursodeoxycholic acid] 3.89 5.5 25.0 HPLC-method I. Orienti 1999
[b-Cyclodextrin](1).[ursodeoxycholic acid] 3.71 5.5 30.0 HPLC-method I. Orienti 1999
[b-Cyclodextrin](1).[ursodeoxycholic acid] 3.19 5.5 37.0 HPLC-method I. Orienti 1999
[b-Cyclodextrin](1).[ursodeoxycholic acid] 3.63 7.0 25.0 HPLC-method I. Orienti 1999
[b-Cyclodextrin](1).[ursodeoxycholic acid] 3.50 7.0 30.0 HPLC-method I. Orienti 1999
[b-Cyclodextrin](1).[ursodeoxycholic acid] 3.21 7.0 37.0 HPLC-method I. Orienti 1999
[BCD polymer](1).[ursodeoxycholic acid] 3.85 7.4 24.0 HPLC-method G. Puglisi 1997
[BCD polymer](1).[ursodeoxycholic acid] 3.70 7.4 37.0 HPLC-method G. Puglisi 1997
[BCD polymer](1).[ursodeoxycholic acid] 3.41 7.4 45.0 HPLC-method G. Puglisi 1997
[Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin isomeric purity >80 %](1).[ursodeoxycholic acid] 3.63 7.4 24.0 HPLC-method G. Puglisi 1997
[Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin isomeric purity >80 %](1).[ursodeoxycholic acid] 3.28 7.4 37.0 HPLC-method G. Puglisi 1997
[Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin isomeric purity >80 %](1).[ursodeoxycholic acid] 2.80 7.4 45.0 HPLC-method G. Puglisi 1997

ursodeoxycholic acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
392.57 4 3 4.48 SF_C1180 None Not checked

SMILES: C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

Supramolecules

Namelog KSDpHT(°C)MethodRef

ursodeoxycholic acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
392.57 4 3 4.48 SF_C1181 None Not checked

SMILES: C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

Supramolecules

Namelog KSDpHT(°C)MethodRef

ursodeoxycholic acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
392.57 4 3 4.48 SF_C398 None Not checked

SMILES: C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

Supramolecules

Namelog KSDpHT(°C)MethodRef
[NC0-b-CD](1).[ursodeoxycholic acid] 5.78 7.0 25.0 Fluorescence spectroscopy Hiroshi Ikeda 2005
[NC4-b-CD](1).[ursodeoxycholic acid] 6.20 7.0 25.0 Fluorescence spectroscopy Hiroshi Ikeda 2005
[NC0-g-CD](1).[ursodeoxycholic acid] 5.18 7.0 25.0 Fluorescence spectroscopy Hiroshi Ikeda 2005