OpenMolDB

Thiocyanate anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
58.08	1	0	0.01				nt1795	None		Not checked

SMILES: [S-]C#N

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

Thiopental

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
242.34	5	2	2.01				nt0846	None		Not checked

SMILES: CCCC(C)C1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[Thiopental]	2.45			25.0		Kenneth A. Connors 1995

Thiopental

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
242.34	5	2	2.01				nt1796	None		Not checked

SMILES: CCCC(C)C1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[Thiopental]	3.43			25.0		Kenneth A. Connors 1995

Thiopental

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
242.34	5	2	2.01				nt1797	None		Not checked

SMILES: CCCC(C)C1(CC)C(=O)NC(=S)NC1=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

Thiopental anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					nt0847	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[Thiopental anion]	2.36			25.0		Kenneth A. Connors 1995

Thiopental anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					nt1798	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[Thiopental anion]	2.59			25.0		Kenneth A. Connors 1995

Thiopental anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					nt1799	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

Thiophenobarbital

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
248.30	5	2	1.52				nt0848	None		Not checked

SMILES: S=C(NC1=O)NC(C1(C2=CC=CC=C2)CC)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[Thiophenobarbital]	3.52			25.0		Kenneth A. Connors 1995

Thiophenobarbital

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
248.30	5	2	1.52				nt1800	None		Not checked

SMILES: S=C(NC1=O)NC(C1(C2=CC=CC=C2)CC)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[Thiophenobarbital]	3.60			25.0		Kenneth A. Connors 1995

Thiophenobarbital

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
248.30	5	2	1.52				nt1801	None		Not checked

SMILES: S=C(NC1=O)NC(C1(C2=CC=CC=C2)CC)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

Thiophenobarbital anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
	None	None					nt1802	None

SMILES:

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[Thiophenobarbital anion]	2.95			25.0		Kenneth A. Connors 1995

Tolnaftate

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
307.41	3	0	4.95				nt1803	None		Not checked

SMILES: CN(C(=S)Oc1ccc2ccccc2c1)c3cccc(C)c3

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[Tolnaftate]	3.85			25.0		Kenneth A. Connors 1995

Toluene

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
92.14	0	0	1.99				nt0849	None		Not checked

SMILES: Cc1ccccc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[Toluene]	1.52			25.0		Kenneth A. Connors 1995

Toluene

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
92.14	0	0	1.99				nt1804	None		Not checked

SMILES: Cc1ccccc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[Toluene]	2.15			25.0		Kenneth A. Connors 1995
[b-Cyclodextrin](1).[Toluene]	2.15		7.0	30.0	Solubility method, titration method	Sophie Fourmentin 2006

Toluene

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
92.14	0	0	1.99				nt1992	None		Not checked

SMILES: Cc1ccccc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[g-Cyclodextrin](1).[Toluene]	1.30			25.0		Kenneth A. Connors 1995