5,5-Diethylthiobarbituric acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
200.26 5 2 0.98 nt0275 None Not checked

SMILES: CCC1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[5,5-Diethylthiobarbituric acid] 2.70 25.0 Kenneth A. Connors 1995

5,5-Diethylthiobarbituric acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
200.26 5 2 0.98 nt1174 None Not checked

SMILES: CCC1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[5,5-Diethylthiobarbituric acid] 2.48 25.0 Kenneth A. Connors 1995

5,5-Diethylthiobarbituric acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
200.26 5 2 0.98 nt1175 None Not checked

SMILES: CCC1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Namelog KSDpHT(°C)MethodRef

5,5-Diethylthiobarbituric acid anion
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
199.25 4 1 0.77 nt1176 None Not checked

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

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[5,5-Diethylthiobarbituric acid anion] 2.08 25.0 Kenneth A. Connors 1995

5-(2,4-difluorophenylsalicylic) acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None SF_C718 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 3.95 1.60 7.4 5.0 Ion selective electrode potentiometry P.E. Macheras 1999
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 3.92 1.60 7.4 15.0 Ion selective electrode potentiometry P.E. Macheras 1999
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 3.75 1.60 7.4 25.0 Ion selective electrode potentiometry P.E. Macheras 1999
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 3.74 1.78 7.4 37.0 Ion selective electrode potentiometry P.E. Macheras 1999
[b-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 6.98 6.66 7.4 5.0 Ion selective electrode potentiometry P.E. Macheras 1999
[b-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 6.63 6.09 7.4 15.0 Ion selective electrode potentiometry P.E. Macheras 1999
[b-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 4.89 3.58 7.4 25.0 Ion selective electrode potentiometry P.E. Macheras 1999
[b-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 4.31 3.00 7.4 37.0 Ion selective electrode potentiometry P.E. Macheras 1999
[g-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 6.30 5.63 7.4 5.0 Ion selective electrode potentiometry P.E. Macheras 1999
[g-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 5.79 5.10 7.4 15.0 Ion selective electrode potentiometry P.E. Macheras 1999
[g-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 4.95 3.97 7.4 25.0 Ion selective electrode potentiometry P.E. Macheras 1999
[g-Cyclodextrin](1).[5-(2,4-difluorophenylsalicylic) acid] 4.77 4.21 7.4 37.0 Ion selective electrode potentiometry P.E. Macheras 1999

5-(4-Bromo-1-naphthoyl)-n-pentyltrimethylammonium
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
363.31 1 0 5.05 nt1034 None Not checked

SMILES: C[N+](C)(C)CCCCCC(=O)c1ccc(Br)c2ccccc12

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[5-(4-Bromo-1-naphthoyl)-n-pentyltrimethylammonium] 2.72 25.0 Kenneth A. Connors 1995

5-Ethyl-5-n-butylbarbituric acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
212.25 5 2 1.60 nt0366 None Not checked

SMILES: CCCCC1(CC)C(=O)NC(=O)NC1=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[5-Ethyl-5-n-butylbarbituric acid] 2.63 25.0 Kenneth A. Connors 1995

5-Ethyl-5-n-butylbarbituric acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
212.25 5 2 1.60 nt1276 None Not checked

SMILES: CCCCC1(CC)C(=O)NC(=O)NC1=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[5-Ethyl-5-n-butylbarbituric acid] 2.68 25.0 Kenneth A. Connors 1995

5-Ethyl-5-n-butylbarbituric acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
212.25 5 2 1.60 nt1277 None Not checked

SMILES: CCCCC1(CC)C(=O)NC(=O)NC1=O

Supramolecules

Namelog KSDpHT(°C)MethodRef

5-Ethyl-5-n-butylbarbituric acid anion
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
211.24 4 1 1.38 nt0367 None Not checked

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

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[5-Ethyl-5-n-butylbarbituric acid anion] 2.34 25.0 Kenneth A. Connors 1995

5-Ethyl-5-n-butylbarbituric acid anion
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
211.24 4 1 1.38 nt1278 None Not checked

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

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[5-Ethyl-5-n-butylbarbituric acid anion] 2.11 25.0 Kenneth A. Connors 1995

5-Ethyl-5-n-butylbarbituric acid anion
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
211.24 4 1 1.38 nt1279 None Not checked

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

Supramolecules

Namelog KSDpHT(°C)MethodRef

5-Ethyl-5-n-butylthiobarbituric acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
228.31 5 2 1.76 nt0368 None Not checked

SMILES: CCCCC1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[5-Ethyl-5-n-butylthiobarbituric acid] 2.78 25.0 Kenneth A. Connors 1995

5-Ethyl-5-n-butylthiobarbituric acid
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
228.31 5 2 1.76 nt1280 None Not checked

SMILES: CCCCC1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[5-Ethyl-5-n-butylthiobarbituric acid] 2.88 25.0 Kenneth A. Connors 1995