Similar Compounds for PubChem Compound (Select 54684141) - PubChem Compound - NCBI

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Select item 546841411.

an image of a chemical structure CID 54684141

Teriflunomide; 163451-81-8; 108605-62-5 ...

MW:: 270.210
MF:: C₁₂H₉F₃N₂O₂

IUPAC name:: (Z)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]but-2-ena...

Create Date:: 2011-12-26

CID:: 54684141

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 547145242.

an image of a chemical structure CID 54714524

CHEMBL999; SCHEMBL2125968; SCHEMBL2760666 ...

MW:: 270.210
MF:: C₁₂H₉F₃N₂O₂

IUPAC name:: (E)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]but-2-ena...

Create Date:: 2011-12-26

CID:: 54714524

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 546779773.

an image of a chemical structure CID 54677977

A77 1726 (E/Z) Mixture; 2-Cyano-3-hydroxy-N-(4-(trifluoromethyl)phenyl)-2-butenamide; CHEMBL2062101 ...

MW:: 270.210
MF:: C₁₂H₉F₃N₂O₂

IUPAC name:: 2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]but-2-enamide

Create Date:: 2011-12-26

CID:: 54677977

Summary Similar Compounds Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 1694365534.

an image of a chemical structure CID 169436553

2-Cyano-N-3-hydroxybut-2-enamino-4-(difluoromethyl)aniline

MW:: 252.220
MF:: C₁₂H₁₀F₂N₂O₂

IUPAC name:: (Z)-2-cyano-N-[4-(difluoromethyl)phenyl]-3-hydroxybut-2-enam...

Create Date:: 2023-12-01

CID:: 169436553

Summary Similar Compounds Same Parent, Connectivity

Select item 1683103935.

an image of a chemical structure CID 168310393

MW:: 286.250
MF:: C₁₃H₁₃F₃N₂O₂

IUPAC name:: (Z)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]but-2-ena...

Create Date:: 2023-06-27

CID:: 168310393

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 1439333546.

an image of a chemical structure CID 143933354

MW:: 300.280
MF:: C₁₄H₁₅F₃N₂O₂

IUPAC name:: (Z)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]but-2-ena...

Create Date:: 2019-12-07

CID:: 143933354

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 713134857.

an image of a chemical structure CID 71313485

Teriflunomide-d4; A77 1726-d4; 1185240-22-5 ...

MW:: 274.230
MF:: C₁₂H₉F₃N₂O₂

IUPAC name:: (Z)-2-cyano-3-hydroxy-N-[2,3,5,6-tetradeuterio-4-(trifluorom...

Create Date:: 2013-05-17

CID:: 71313485

Summary Similar Compounds Same Parent, Connectivity

Select item 1398407938.

an image of a chemical structure CID 139840793

MW:: 284.230
MF:: C₁₃H₁₁F₃N₂O₂

IUPAC name:: (Z)-2-cyano-3-hydroxy-N-[4-(2,2,2-trifluoroethyl)phenyl]but-...

Create Date:: 2019-12-05

CID:: 139840793

Summary Similar Compounds Same Parent, Connectivity

Select item 591804819.

an image of a chemical structure CID 59180481

SCHEMBL12312432

MW:: 266.240
MF:: C₁₃H₁₂F₂N₂O₂

IUPAC name:: (Z)-2-cyano-N-[4-(1,1-difluoroethyl)phenyl]-3-hydroxybut-2-e...

Create Date:: 2012-08-20

CID:: 59180481

Summary Similar Compounds Same Parent, Connectivity

Select item 5915775110.

an image of a chemical structure CID 59157751

SCHEMBL13529056

MW:: 284.230
MF:: C₁₃H₁₁F₃N₂O₂

IUPAC name:: (Z)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]pent-2-en...

Create Date:: 2012-08-20

CID:: 59157751

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 5472682611.

an image of a chemical structure CID 54726826

MW:: 309.300
MF:: C₁₂H₉F₃KN₂O₂

Create Date:: 2011-12-27

CID:: 54726826

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 5472682512.

an image of a chemical structure CID 54726825

SCHEMBL992140; SCHEMBL8466730

MW:: 293.200
MF:: C₁₂H₉F₃N₂NaO₂

Create Date:: 2011-12-27

CID:: 54726825

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 9035063013.

an image of a chemical structure CID 90350630

SCHEMBL15963917; 2-Cyano-N-(4-(fluoromethyl)phenyl)-3-hydroxybut-2-enamide

MW:: 234.230
MF:: C₁₂H₁₁FN₂O₂

IUPAC name:: (Z)-2-cyano-N-[4-(fluoromethyl)phenyl]-3-hydroxybut-2-enamid...

Create Date:: 2015-02-13

CID:: 90350630

Summary Similar Compounds Same Parent, Connectivity

Select item 5734008114.

an image of a chemical structure CID 57340081

MW:: 312.290
MF:: C₁₅H₁₅F₃N₂O₂

IUPAC name:: (Z)-2-cyano-3-hydroxy-4,4-dimethyl-N-[4-(trifluoromethyl)phe...

Create Date:: 2012-07-07

CID:: 57340081

Summary Similar Compounds Same Parent, Connectivity

Select item 5470859415.

an image of a chemical structure CID 54708594

N-[4-(Trifluoromethyl)phenyl]-2-cyano-3-hydroxy-4-methyl-2-pentenamide; SCHEMBL18120684; ZINC101070690

MW:: 298.260
MF:: C₁₄H₁₃F₃N₂O₂

IUPAC name:: (Z)-2-cyano-3-hydroxy-4-methyl-N-[4-(trifluoromethyl)phenyl]...

Create Date:: 2011-12-26

CID:: 54708594

Summary Similar Compounds Same Parent, Connectivity

Select item 14135723316.

an image of a chemical structure CID 141357233

MW:: 324.180
MF:: C₁₂H₆F₆N₂O₂

IUPAC name:: 2-cyano-4,4,4-trifluoro-3-hydroxy-N-[4-(trifluoromethyl)phen...

Create Date:: 2019-12-06

CID:: 141357233

Summary Similar Compounds Same Parent, Connectivity

Select item 8674781217.

an image of a chemical structure CID 86747812

SCHEMBL9181216; (E)-2-cyano-3-hydroxy-N-(4-trifluoromethylphenyl)-hexa-2,4-dienamide

MW:: 296.240
MF:: C₁₄H₁₁F₃N₂O₂

IUPAC name:: (2E)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]hexa-2,4...

Create Date:: 2015-02-02

CID:: 86747812

Summary Similar Compounds Same Parent, Connectivity

Select item 7618506818.

an image of a chemical structure CID 76185068

MW:: 296.240
MF:: C₁₄H₁₁F₃N₂O₂

IUPAC name:: 2-cyano-3-hydroxy-4-methyl-N-[4-(trifluoromethyl)phenyl]pent...

Create Date:: 2014-07-24

CID:: 76185068

Summary Similar Compounds Same Parent, Connectivity

Select item 7617883619.

an image of a chemical structure CID 76178836

2-cyano-3-hydroxy-N-(4-trifluoromethylphenyl)-penta-2,4-dienamide

MW:: 282.220
MF:: C₁₃H₉F₃N₂O₂

IUPAC name:: 2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]penta-2,4-die...

Create Date:: 2014-07-24

CID:: 76178836

Summary Similar Compounds Same Parent, Connectivity

Select item 6784058320.

an image of a chemical structure CID 67840583

MW:: 324.300
MF:: C₁₆H₁₅F₃N₂O₂

IUPAC name:: 2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]octa-2,6-dien...

Create Date:: 2012-11-30

CID:: 67840583

Summary Similar Compounds Same Parent, Connectivity

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Chemical Properties

Rule of 5 (258)
Compounds satisfied Lipinski's Rule of Five in evaluating druglikeness. Query: (-5:5[LOGP]) AND (0:500[MOLWT]) AND (0:5[HBDC]) AND (0:10[HBAC]).

BioActivity Experiments

BioAssays, Active (18)
Compounds identified as active in screening experiments

BioAssays, Tested (34)
Compounds identified as tested in screening experiments

Protein 3D Structures (1)
Compounds bound to proteins in atructure biology experiments

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Pharmacological Actions (2)
Therapeutic use and National Library of Medicine (NLM) compound classifications

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Similar Compounds for PubChem Compound (Select 54684141) (293)
PubChem Compound
Blood from septic patients: time course
Blood from septic patients: time course
Accession: GDS4971

GEO DataSets
Related DataSets for GEO Profiles (Select 108606703) (1)
GEO DataSets
OMIM Links for Nucleotide (Select 1519315533) (2)
OMIM
BTN3A1 butyrophilin subfamily 3 member A1 [Homo sapiens]
BTN3A1 butyrophilin subfamily 3 member A1 [Homo sapiens]
Gene ID:11119

Gene

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