OpenMolDB

4-Methylbenzoic acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
135.14	1	0	0.36				nt1468	None		Not checked

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

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[4-Methylbenzoic acid anion]	2.04			25.0		Kenneth A. Connors 1995

4-Methylbenzophenone

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
196.24	1	0	3.23				nt1471	None		Not checked

SMILES: Cc1ccc(cc1)C(=O)c2ccccc2

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[4-Methylbenzophenone]	2.89			25.0		Kenneth A. Connors 1995

4-Methylcinnamic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
162.19	2	1	2.09				nt0561	None		Not checked

SMILES: Cc1ccc(cc1)C=CC(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[4-Methylcinnamic acid]	4.13			25.0		Kenneth A. Connors 1995

4-Methylcinnamic acid

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
162.19	2	1	2.09				nt1483	None		Not checked

SMILES: Cc1ccc(cc1)C=CC(O)=O

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[4-Methylcinnamic acid]	2.64			25.0		Kenneth A. Connors 1995

4-Methylcinnamic acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
161.18	1	0	0.76				nt0562	None		Not checked

SMILES: O=C([O-])C=CC1=CC=C(C)C=C1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[4-Methylcinnamic acid anion]	2.55			25.0		Kenneth A. Connors 1995

4-Methylcinnamic acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
161.18	1	0	0.76				nt0563	None		Not checked

SMILES: O=C([O-])C=CC1=CC=C(C)C=C1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

4-Methylcinnamic acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
161.18	1	0	0.76				nt0564	None		Not checked

SMILES: O=C([O-])C=CC1=CC=C(C)C=C1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

4-Methylcinnamic acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
161.18	1	0	0.76				nt0565	None		Not checked

SMILES: O=C([O-])C=CC1=CC=C(C)C=C1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

4-Methylcinnamic acid anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
161.18	1	0	0.76				nt1484	None		Not checked

SMILES: O=C([O-])C=CC1=CC=C(C)C=C1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[4-Methylcinnamic acid anion]	2.67			25.0		Kenneth A. Connors 1995

4-Methylphenol

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
108.14	1	1	1.70				nt0596	None		Not checked

SMILES: Cc1ccc(O)cc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[4-Methylphenol]	1.57			25.0		Kenneth A. Connors 1995

4-Methylphenol

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
108.14	1	1	1.70				nt0597	None		Not checked

SMILES: Cc1ccc(O)cc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

4-Methylphenol

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
108.14	1	1	1.70				nt0598	None		Not checked

SMILES: Cc1ccc(O)cc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

4-Methylphenol

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
108.14	1	1	1.70				nt1511	None		Not checked

SMILES: Cc1ccc(O)cc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[4-Methylphenol]	2.61			25.0		Kenneth A. Connors 1995

4-Methylphenol

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
108.14	1	1	1.70				nt1512	None		Not checked

SMILES: Cc1ccc(O)cc1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref

4-Methylphenol anion

MW	HBA	HBD	LogP	CAS	Suppliers	Supplier IDs	Storage ID	Quantity	Class	PAINS
109.15	1	1	1.06				nt0599	None		Not checked

SMILES: CC1=CCC(O)[C-]=C1

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[a-Cyclodextrin](1).[4-Methylphenol anion]	2.21			25.0		Kenneth A. Connors 1995