3,5-Dimethyl-4-hydroxyhydrocinnamic acid anion
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
193.22 2 1 0.69 nt0319 None Not checked

SMILES: O=C([O-])CCC1=CC(C)=C(O)C(C)=C1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[3,5-Dimethyl-4-hydroxyhydrocinnamic acid anion] 1.83 25.0 Kenneth A. Connors 1995

3,5-Dimethyl-4-hydroxyhydrocinnamic acid anion
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
193.22 2 1 0.69 nt0320 None Not checked

SMILES: O=C([O-])CCC1=CC(C)=C(O)C(C)=C1

Supramolecules

Namelog KSDpHT(°C)MethodRef

3,5-Dimethylphenyl acetate
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
164.20 2 0 2.23 nt0335 None Not checked

SMILES: CC(=O)Oc1cc(C)cc(C)c1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[3,5-Dimethylphenyl acetate] 1.82 25.0 Kenneth A. Connors 1995

3,5-Dimethylphenyl acetate
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
164.20 2 0 2.23 nt0336 None Not checked

SMILES: CC(=O)Oc1cc(C)cc(C)c1

Supramolecules

Namelog KSDpHT(°C)MethodRef

3,5-Dimethylphenyl acetate
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
164.20 2 0 2.23 nt1219 None Not checked

SMILES: CC(=O)Oc1cc(C)cc(C)c1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[3,5-Dimethylphenyl acetate] 2.06 25.0 Kenneth A. Connors 1995

3,5-DinitroBenzoic acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
212.12 4 1 2.25 nt1223 None Not checked

SMILES: OC(=O)c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[3,5-DinitroBenzoic acid] 3.62 25.0 Kenneth A. Connors 1995

3,5-DinitroBenzoic acid anion
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
211.11 3 0 0.91 nt1224 None Not checked

SMILES: O=C([O-])C1=CC([N+]([O-])=O)=CC([N+]([O-])=O)=C1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[3,5-DinitroBenzoic acid anion] 3.10 25.0 Kenneth A. Connors 1995

3,5-dimethoxy benzoate ion
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
181.17 3 0 0.07 JN_352 None Not checked

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

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[3,5-dimethoxy benzoate ion] 1.67 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[b-Cyclodextrin](1).[3,5-dimethoxy benzoate ion] 1.80 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[cyclomaltodecaose](1).[3,5-dimethoxy benzoate ion] 0.95 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[cyclomaltododecaose](1).[3,5-dimethoxy benzoate ion] 0.95 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[cyclomaltononaose](1).[3,5-dimethoxy benzoate ion] 0.90 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[cyclomaltotridecaose](1).[3,5-dimethoxy benzoate ion] 1.08 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[cyclomaltoundecaose](1).[3,5-dimethoxy benzoate ion] 1.00 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[g-Cyclodextrin](1).[3,5-dimethoxy benzoate ion] 1.00 25.0 capillary electrophoresis Wolfgang Zimmermann 1998

3,5-dimethyl benzoate ion
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
149.17 1 0 0.67 JN_351 None Not checked

SMILES: O=C([O-])C1=CC(C)=CC(C)=C1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[3,5-dimethyl benzoate ion] 1.59 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[b-Cyclodextrin](1).[3,5-dimethyl benzoate ion] 0.95 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[cyclomaltodecaose](1).[3,5-dimethyl benzoate ion] 0.70 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[cyclomaltododecaose](1).[3,5-dimethyl benzoate ion] 0.90 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[cyclomaltononaose](1).[3,5-dimethyl benzoate ion] 0.30 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[cyclomaltotridecaose](1).[3,5-dimethyl benzoate ion] 0.90 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[cyclomaltoundecaose](1).[3,5-dimethyl benzoate ion] 0.85 25.0 capillary electrophoresis Wolfgang Zimmermann 1998
[g-Cyclodextrin](1).[3,5-dimethyl benzoate ion] 0.85 25.0 capillary electrophoresis Wolfgang Zimmermann 1998

3-(2,3-Dimethylanilino)benzoic acid anion
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
240.28 2 1 2.48 nt1202 None Not checked

SMILES: O=C([O-])C1=CC=CC(NC2=CC=CC(C)=C2C)=C1

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[3-(2,3-Dimethylanilino)benzoic acid anion] 2.94 25.0 Kenneth A. Connors 1995

3-(2-Methyl-n-propyl)-4-hydroxyphenylazobenzene-4-sulfonate
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
335.40 5 1 4.20 nt0612 None Not checked

SMILES: CC(C)CC1C=C(C=CC1(O)[S]([O-])(=O)=O)N=Nc2ccccc2

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[3-(2-Methyl-n-propyl)-4-hydroxyphenylazobenzene-4-sulfonate] 3.77 25.0 Kenneth A. Connors 1995

3-(2-hydroxyphenyl)- propionicacid

MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
166.17 3 2 1.41 SF_C1556 None Not checked

SMILES: OC(=O)CCc1ccccc1O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[mono-(6-amino-6-deoxy)-b-CD](1).[3-(2-hydroxyphenyl)- propionicacid ] 2.14 0.30 6.9 25.0 Titration Calorimetry Yoshihisa Inoue 2002
[b-Cyclodextrin](1).[3-(2-hydroxyphenyl)- propionicacid ] 1.91 0.30 6.9 25.0 Titration Calorimetry Yoshihisa Inoue 2002