OpenMolDB

5-Ethyl-5-n-pentylthiobarbituric acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
242.34	5	2	2.15				nt1306	None		Not checked

SMILES: CCCCCC1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

5-Ethyl-5-n-pentylthiobarbituric acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
241.33	4	1	1.94				nt0388	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[5-Ethyl-5-n-pentylthiobarbituric acid anion]	2.68			25.0		Kenneth A. Connors 1995

5-Ethyl-5-n-pentylthiobarbituric acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
241.33	4	1	1.94				nt1307	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[5-Ethyl-5-n-pentylthiobarbituric acid anion]	2.72			25.0		Kenneth A. Connors 1995

5-Ethyl-5-n-pentylthiobarbituric acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
241.33	4	1	1.94				nt1308	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

5-Ethyl-5-n-propylbarbituric acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
198.22	5	2	1.21				nt0390	None		Not checked

SMILES: CCCC1(CC)C(=O)NC(=O)NC1=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[5-Ethyl-5-n-propylbarbituric acid]	2.72			25.0		Kenneth A. Connors 1995

5-Ethyl-5-n-propylbarbituric acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
198.22	5	2	1.21				nt1311	None		Not checked

SMILES: CCCC1(CC)C(=O)NC(=O)NC1=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[5-Ethyl-5-n-propylbarbituric acid]	2.26			25.0		Kenneth A. Connors 1995

5-Ethyl-5-n-propylbarbituric acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
198.22	5	2	1.21				nt1312	None		Not checked

SMILES: CCCC1(CC)C(=O)NC(=O)NC1=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

5-Ethyl-5-n-propylbarbituric acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
197.21	4	1	0.99				nt0391	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[5-Ethyl-5-n-propylbarbituric acid anion]	2.34			25.0		Kenneth A. Connors 1995

5-Ethyl-5-n-propylbarbituric acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
197.21	4	1	0.99				nt1313	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[5-Ethyl-5-n-propylbarbituric acid anion]	2.04			25.0		Kenneth A. Connors 1995

5-Ethyl-5-n-propylbarbituric acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
197.21	4	1	0.99				nt1314	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

5-Ethyl-5-n-propylthiobarbituric acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
214.28	5	2	1.37				nt0392	None		Not checked

SMILES: CCCC1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[5-Ethyl-5-n-propylthiobarbituric acid]	2.88			25.0		Kenneth A. Connors 1995

5-Ethyl-5-n-propylthiobarbituric acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
214.28	5	2	1.37				nt1315	None		Not checked

SMILES: CCCC1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[5-Ethyl-5-n-propylthiobarbituric acid]	2.48			25.0		Kenneth A. Connors 1995

5-Ethyl-5-n-propylthiobarbituric acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
214.28	5	2	1.37				nt1316	None		Not checked

SMILES: CCCC1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

5-Ethyl-5-n-propylthiobarbituric acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
213.28	4	1	1.16				nt0393	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[5-Ethyl-5-n-propylthiobarbituric acid anion]	2.38			25.0		Kenneth A. Connors 1995

5-Ethyl-5-n-propylthiobarbituric acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
213.28	4	1	1.16				nt1317	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[5-Ethyl-5-n-propylthiobarbituric acid anion]	2.11			25.0		Kenneth A. Connors 1995