Compounds, activity concentration at/below 1 uM for PubChem BioAssay ( - PubChem Compound - NCBI

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Select item 1355467891.

an image of a chemical structure CID 135546789

2-({5-[1-(4-FLUOROBENZENESULFONYL)PIPERIDIN-3-YL]-7-HYDROXY-3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDIN-3-YL}METHYL)BENZONITRILE; CHEMBL1397562; HMS1848A20 ...

MW:: 493.500
MF:: C₂₃H₂₀FN₇O₃S

IUPAC name:: 2-[[5-[1-(4-fluorophenyl)sulfonylpiperidin-3-yl]-7-oxo-6H-tr...

Create Date:: 2019-01-15

CID:: 135546789

Summary Same Parent, Connectivity

Select item 1354655392.

an image of a chemical structure CID 135465539

ACHP; 406208-42-2; CHEMBL368427 ...

MW:: 364.400
MF:: C₂₁H₂₄N₄O₂

IUPAC name:: 2-amino-6-[2-(cyclopropylmethoxy)-6-hydroxyphenyl]-4-piperid...

Create Date:: 2019-01-15

CID:: 135465539

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 1354094533.

an image of a chemical structure CID 135409453

Tegaserod; 145158-71-0; Zelnorm ...

MW:: 301.390
MF:: C₁₆H₂₃N₅O

IUPAC name:: 1-[(E)-(5-methoxy-1H-indol-3-yl)methylideneamino]-2-pentylgu...

Create Date:: 2019-01-15

CID:: 135409453

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

Select item 1330538564.

an image of a chemical structure CID 133053856

NCGC00384170-01

MW:: 388.600
MF:: C₂₂H₃₂N₂O₂S

IUPAC name:: 2-(2-methylbutylamino)-1-[4-[(3-methylphenoxy)methyl]-4,6,7,...

Create Date:: 2018-05-02

CID:: 133053856

Summary Same Parent, Connectivity

Select item 918260885.

an image of a chemical structure CID 91826088

CU-T12-9; 1821387-73-8; N-methyl-4-nitro-2-(4-(4-(trifluoromethyl)phenyl)-1H-imidazol-1-yl)aniline ...

MW:: 362.310
MF:: C₁₇H₁₃F₃N₄O₂

IUPAC name:: N-methyl-4-nitro-2-[4-[4-(trifluoromethyl)phenyl]imidazol-1-...

Create Date:: 2015-08-06

CID:: 91826088

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 917996706.

an image of a chemical structure CID 91799670

CHEMBL3770919; SCHEMBL16769462; NCGC00351414-01

MW:: 349.300
MF:: C₁₉H₂₂Cl₂N₂

IUPAC name:: 1-[bis(4-chlorophenyl)methyl]-4-ethylpiperazine

Create Date:: 2015-06-15

CID:: 91799670

Summary Same Parent, Connectivity

Select item 786738617.

an image of a chemical structure CID 78673861

UNC-2170; 3-Bromo-N-[3-(Tert-Butylamino)propyl]benzamide; 3-Bromo-N-(3-(tert-butylamino)propyl)benzamide ...

MW:: 313.230
MF:: C₁₄H₂₁BrN₂O

IUPAC name:: 3-bromo-N-[3-(tert-butylamino)propyl]benzamide

Create Date:: 2014-10-16

CID:: 78673861

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

Select item 771472338.

an image of a chemical structure CID 77147233

SCHEMBL21840797; HMS3653I15; HMS3743A17 ...

MW:: 465.600
MF:: C₂₇H₃₁NO₄S

IUPAC name:: [1-[[4-[[3-(benzenesulfonylmethyl)-5-methylphenoxy]methyl]ph...

Create Date:: 2014-09-10

CID:: 77147233

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 732652699.

an image of a chemical structure CID 73265269

NCGC00247733-01

MW:: 504.100
MF:: C₂₉H₄₂ClNO₄

IUPAC name:: (1S,2S,6S,14R,15R,16R)-5-(cyclopropylmethyl)-16-[(2S)-2-hydr...

Create Date:: 2014-03-21

CID:: 73265269

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 7279392810.

an image of a chemical structure CID 72793928

CHEMBL4059630; SCHEMBL17348124; BDBM345924 ...

MW:: 470.600
MF:: C₂₇H₃₉FN₄O₂

IUPAC name:: N-[3-[(3S,5R)-3,5-dimethylpiperidin-1-yl]propyl]-1-[[2-(4-fl...

Create Date:: 2014-02-25

CID:: 72793928

Summary Same Parent, Connectivity

Select item 7172152511.

an image of a chemical structure CID 71721525

UNC2881; 1493764-08-1; N-(4-(1H-Imidazol-1-yl)benzyl)-2-(butylamino)-4-(((1r,4r)-4-hydroxycyclohexyl)amino)pyrimidine-5-carboxamide ...

MW:: 463.600
MF:: C₂₅H₃₃N₇O₂

IUPAC name:: 2-(butylamino)-4-[(4-hydroxycyclohexyl)amino]-N-[(4-imidazol...

Create Date:: 2013-09-30

CID:: 71721525

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 7157668912.

an image of a chemical structure CID 71576689

gamma-secretase modulator 3; 1431697-84-5; 4-(4-fluorophenyl)-N-(3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl)-4,5,6,7-tetrahydrobenzo[d]thiazol-2-amine ...

MW:: 434.500
MF:: C₂₄H₂₃FN₄OS

IUPAC name:: 4-(4-fluorophenyl)-N-[3-methoxy-4-(4-methylimidazol-1-yl)phe...

Create Date:: 2013-06-26

CID:: 71576689

Summary Same Parent, Connectivity

Select item 7115852313.

an image of a chemical structure CID 71158523

VK-II-86; 955371-84-3; methoxyphenoxy)ethylamino) ...

MW:: 420.500
MF:: C₂₅H₂₈N₂O₄

IUPAC name:: 4-(9H-carbazol-4-yloxy)-1-[2-(2-methoxyphenoxy)ethylamino]bu...

Create Date:: 2013-03-21

CID:: 71158523

Summary Same Parent, Connectivity

Select item 6655828714.

an image of a chemical structure CID 66558287

NLG919; 1402836-58-1; 1-cyclohexyl-2-(5H-imidazo[5,1-a]isoindol-5-yl)ethanol ...

MW:: 282.400
MF:: C₁₈H₂₂N₂O

IUPAC name:: 1-cyclohexyl-2-(5H-imidazo[5,1-a]isoindol-5-yl)ethanol

Create Date:: 2012-11-12

CID:: 66558287

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

Select item 6019636215.

an image of a chemical structure CID 60196362

DTXSID9049037; DTXCID4028963; CAS-127308-98-9 ...

MW:: 531.600
MF:: C₃₁H₃₃NO₇

IUPAC name:: (3S)-3-benzhydryloxy-1-[2-(1,3-benzodioxol-5-yl)ethyl]piperi...

Create Date:: 2012-10-06

CID:: 60196362

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 6019632416.

an image of a chemical structure CID 60196324

Thiofentanyl hydrochloride; 79278-88-9; 51ANLEZ9AK ...

MW:: 379.000
MF:: C₂₀H₂₇ClN₂OS

IUPAC name:: N-phenyl-N-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]propanami...

Create Date:: 2012-10-06

CID:: 60196324

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 6019632217.

an image of a chemical structure CID 60196322

117332-94-2; 2DZ62M473M; NIH 10538 ...

MW:: 393.000
MF:: C₂₁H₂₉ClN₂OS

IUPAC name:: N-phenyl-N-[1-(1-thiophen-2-ylpropan-2-yl)piperidin-4-yl]pro...

Create Date:: 2012-10-06

CID:: 60196322

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 6019624418.

an image of a chemical structure CID 60196244

IRE1alpha kinase-IN-2; 1414938-21-8; Urea, N-[4-[8-aMino-3-(1-Methylethyl)iMidazo[1,5-a]pyrazin-1-yl]-1-naphthalenyl]-N'-[3-(trifluoroMethyl)phenyl]- ...

MW:: 504.500
MF:: C₂₇H₂₃F₃N₆O

IUPAC name:: 1-[4-(8-amino-3-propan-2-ylimidazo[1,5-a]pyrazin-1-yl)naphth...

Create Date:: 2012-10-04

CID:: 60196244

Summary Same Parent, Connectivity

Select item 6016755019.

an image of a chemical structure CID 60167550

CHEBI:91427; HMS3295M17; BCP9000801 ...

MW:: 328.400
MF:: C₂₁H₂₀N₄

IUPAC name:: 1-N-[2-(1H-indol-3-yl)ethyl]-3-N-pyridin-4-ylbenzene-1,3-dia...

Create Date:: 2012-09-20

CID:: 60167550

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 6015621420.

an image of a chemical structure CID 60156214

MLS004801944; CHEMBL3183591; SCHEMBL16944533 ...

MW:: 412.300
MF:: C₁₈H₂₆BrN₃O₃

IUPAC name:: methyl 5-bromo-2-[4-(cyclohexylamino)-3-hydroxypiperidin-1-y...

Create Date:: 2012-09-11

CID:: 60156214

Summary Same Parent, Connectivity Mixture/Component Compounds

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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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