PubChem Compound Links for Gene (Select 114789) - PubChem Compound - NCBI

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Select item 716629601.

an image of a chemical structure CID 71662960

(1s,6r)-3-[2-(3,4-Dimethoxyphenoxy)ethyl]-10-[(2-Oxo-2,3-Dihydro-1,3-Benzothiazol-6-Yl)sulfonyl]-3,10-Diazabicyclo[4.3.1]decan-2-One; 4jfk; Q27461689 ...

MW:: 547.600
MF:: C₂₅H₂₉N₃O₇S₂

IUPAC name:: 6-[[(1S,6R)-3-[2-(3,4-dimethoxyphenoxy)ethyl]-2-oxo-3,10-dia...

Create Date:: 2013-08-26

CID:: 71662960

Summary Same Parent, Connectivity

Select item 546841412.

an image of a chemical structure CID 54684141

Teriflunomide; 163451-81-8; Aubagio ...

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 Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 251045643.

an image of a chemical structure CID 25104564

LDC000067; 1073485-20-7; (3-((6-(2-methoxyphenyl)pyrimidin-4-yl)amino)phenyl)methanesulfonamide ...

MW:: 370.400
MF:: C₁₈H₁₈N₄O₃S

IUPAC name:: [3-[[6-(2-methoxyphenyl)pyrimidin-4-yl]amino]phenyl]methanes...

Create Date:: 2008-12-22

CID:: 25104564

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 249785444.

an image of a chemical structure CID 24978544

PCI 5002; bis[1-(hydroxy-kO)-5-{[2-(2-methoxyethoxy)ethoxy]methyl}-2-(sulfanyl-kS)pyridiniumato(2-)]zinc

MW:: 584.000
MF:: C₂₂H₃₄N₂O₈S₂Zn

IUPAC name:: 1-hydroxy-5-[2-(2-methoxyethoxy)ethoxymethyl]pyridin-1-ium-2...

Create Date:: 2008-10-27

CID:: 24978544

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

Select item 69188375.

an image of a chemical structure CID 6918837

Panobinostat; 404950-80-7; LBH589 ...

MW:: 349.400
MF:: C₂₁H₂₃N₃O₂

IUPAC name:: (E)-N-hydroxy-3-[4-[[2-(2-methyl-1H-indol-3-yl)ethylamino]me...

Create Date:: 2006-07-28

CID:: 6918837

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 65098636.

an image of a chemical structure CID 6509863

Cgp 52608; 87958-67-6; Cgp-52608 ...

MW:: 244.300
MF:: C₈H₁₂N₄OS₂

IUPAC name:: 1-methyl-3-[(E)-(4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylide...

Create Date:: 2006-05-02

CID:: 6509863

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 53595967.

an image of a chemical structure CID 5359596

7440-38-2; Arsenic; As ...

MW:: 74.922
MF:: As

IUPAC name:: arsenic

Create Date:: 2005-06-24

CID:: 5359596

Select item 53291028.

an image of a chemical structure CID 5329102

Sunitinib; 557795-19-4; Sutent ...

MW:: 398.500
MF:: C₂₂H₂₇FN₄O₂

IUPAC name:: N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-...

Create Date:: 2006-01-30

CID:: 5329102

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 53189999.

an image of a chemical structure CID 5318999

Licochalcone B; 58749-23-8; LicochalconeB ...

MW:: 286.280
MF:: C₁₆H₁₄O₅

IUPAC name:: (E)-3-(3,4-dihydroxy-2-methoxyphenyl)-1-(4-hydroxyphenyl)pro...

Create Date:: 2006-01-18

CID:: 5318999

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 528437310.

an image of a chemical structure CID 5284373

cyclosporin A; cyclosporine; Ciclosporin ...

MW:: 1202.600
MF:: C₆₂H₁₁₁N₁₁O₁₂

IUPAC name:: (3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-30-ethyl-33-[(E,1R,2R...

Create Date:: 2005-11-20

CID:: 5284373

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 44473211.

an image of a chemical structure CID 444732

trichostatin A; 58880-19-6; TSA ...

MW:: 302.370
MF:: C₁₇H₂₂N₂O₃

IUPAC name:: (2E,4E,6R)-7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethy...

Create Date:: 2005-06-01

CID:: 444732

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 44349512.

an image of a chemical structure CID 443495

SODIUM ARSENITE; 7784-46-5; Sodium metaarsenite ...

MW:: 129.910
MF:: AsNaO₂

IUPAC name:: sodium;oxoarsinite

Create Date:: 2005-03-27

CID:: 443495

Summary Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 44132513.

an image of a chemical structure CID 441325

Amiodarone hydrochloride; 19774-82-4; Amiodarone HCL ...

MW:: 681.800
MF:: C₂₅H₃₀ClI₂NO₃

IUPAC name:: (2-butyl-1-benzofuran-3-yl)-[4-[2-(diethylamino)ethoxy]-3,5-...

Create Date:: 2005-06-24

CID:: 441325

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

Select item 40930114.

an image of a chemical structure CID 409301

METHYLMERCURY CHLORIDE; 115-09-3; Methylmercuric chloride ...

MW:: 251.080
MF:: CH₃ClHg

IUPAC name:: chloro(methyl)mercury

Create Date:: 2005-03-26

CID:: 409301

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 18690715.

an image of a chemical structure CID 186907

AFLATOXIN B1; 1162-65-8; AFB1 ...

MW:: 312.270
MF:: C₁₇H₁₂O₆

IUPAC name:: (3S,7R)-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7....

Create Date:: 2004-09-16

CID:: 186907

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 16051116.

an image of a chemical structure CID 160511

Abrine; L-Abrine; 526-31-8 ...

MW:: 218.250
MF:: C₁₂H₁₄N₂O₂

IUPAC name:: (2S)-3-(1H-indol-3-yl)-2-(methylamino)propanoic acid

Create Date:: 2005-06-24

CID:: 160511

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 9517017.

an image of a chemical structure CID 95170

5436-43-1; 2,2',4,4'-Tetrabromodiphenyl ether; 4,4'-Oxybis(1,3-dibromobenzene) ...

MW:: 485.790
MF:: C₁₂H₆Br₄O

IUPAC name:: 2,4-dibromo-1-(2,4-dibromophenoxy)benzene

Create Date:: 2005-03-26

CID:: 95170

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 4132218.

an image of a chemical structure CID 41322

55097-80-8; BPDE; Benzo(a)pyrene diol epoxide ...

MW:: 302.300
MF:: C₂₀H₁₄O₃

IUPAC name:: 4-oxahexacyclo[11.6.2.02,8.03,5.010,20.017,21]henicosa-1(20)...

Create Date:: 2004-09-16

CID:: 41322

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 2617719.

an image of a chemical structure CID 26177

13674-87-8; TDCPP; Tris(1,3-dichloro-2-propyl)phosphate ...

MW:: 430.900
MF:: C₉H₁₅Cl₆O₄P

IUPAC name:: tris(1,3-dichloropropan-2-yl) phosphate

Create Date:: 2005-03-27

CID:: 26177

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 2482320.

an image of a chemical structure CID 24823

OZONE; Triatomic oxygen; 10028-15-6 ...

MW:: 47.998
MF:: O₃

IUPAC name:: ozone

Create Date:: 2005-08-01

CID:: 24823

Summary PubMed (MeSH Keyword)

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Chemical Properties

Rule of 5 (28)
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]).

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Compounds identified as tested in screening experiments

Protein 3D Structures (16)
Compounds bound to proteins in atructure biology experiments

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Pharmacological Actions (22)
Therapeutic use and National Library of Medicine (NLM) compound classifications
BioSystems (16)
Compounds involved in biological pathways

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PubChem Compound Links for Gene (Select 114789) (39)
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