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

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Select item 1354094531.

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 167228362.

an image of a chemical structure CID 16722836

Fedratinib; 936091-26-8; Tg-101348 ...

MW:: 524.700
MF:: C₂₇H₃₆N₆O₃S

IUPAC name:: N-tert-butyl-3-[[5-methyl-2-[4-(2-pyrrolidin-1-ylethoxy)anil...

Create Date:: 2007-09-03

CID:: 16722836

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

Select item 116229093.

an image of a chemical structure CID 11622909

Midalcipran; 2-(aminomethyl)-N,N-diethyl-1-phenylcyclopropane-1-carboxamide; 136090-84-1 ...

MW:: 246.350
MF:: C₁₅H₂₂N₂O

IUPAC name:: 2-(aminomethyl)-N,N-diethyl-1-phenylcyclopropane-1-carboxami...

Create Date:: 2006-10-26

CID:: 11622909

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

Select item 95520794.

an image of a chemical structure CID 9552079

chlorhexidine; 55-56-1; Rotersept ...

MW:: 505.400
MF:: C₂₂H₃₀Cl₂N₁₀

IUPAC name:: (1E)-2-[6-[[amino-[(E)-[amino-(4-chloroanilino)methylidene]a...

Create Date:: 2006-10-23

CID:: 9552079

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

Select item 53110175.

an image of a chemical structure CID 5311017

benzphetamine; Benzfetamine; d-Benzphetamine ...

MW:: 239.350
MF:: C₁₇H₂₁N

IUPAC name:: (2S)-N-benzyl-N-methyl-1-phenylpropan-2-amine

Create Date:: 2005-12-16

CID:: 5311017

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

Select item 52845506.

an image of a chemical structure CID 5284550

Dosulepin; trans-dothiepin; Dosulepine ...

MW:: 295.400
MF:: C₁₉H₂₁NS

IUPAC name:: (3E)-3-(6H-benzo[c][1]benzothiepin-11-ylidene)-N,N-dimethylp...

Create Date:: 2005-03-26

CID:: 5284550

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

Select item 52810357.

an image of a chemical structure CID 5281035

PYRVINIUM; 7187-62-4; Pyrvinum ...

MW:: 382.500
MF:: C₂₆H₂₈N₃⁺

IUPAC name:: 2-[(E)-2-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethenyl]-N,N,1-tr...

Create Date:: 2005-03-26

CID:: 5281035

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

Select item 30226458.

an image of a chemical structure CID 3022645

CHEMBL14370; 2-[(2-ethoxyphenoxy)-phenylmethyl]morpholine; 98769-81-4 ...

MW:: 313.400
MF:: C₁₉H₂₃NO₃

IUPAC name:: 2-[(2-ethoxyphenoxy)-phenylmethyl]morpholine

Create Date:: 2005-08-08

CID:: 3022645

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 6674679.

an image of a chemical structure CID 667467

chlorprothixene; 113-59-7; Taractan ...

MW:: 315.900
MF:: C₁₈H₁₈ClNS

IUPAC name:: (3Z)-3-(2-chlorothioxanthen-9-ylidene)-N,N-dimethylpropan-1-...

Create Date:: 2005-03-25

CID:: 667467

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

Select item 15425710.

an image of a chemical structure CID 154257

Bazedoxifene; 198481-32-2; TSE-424 ...

MW:: 470.600
MF:: C₃₀H₃₄N₂O₃

IUPAC name:: 1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-2-(4-hydroxyphen...

Create Date:: 2005-08-08

CID:: 154257

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

Select item 6085411.

an image of a chemical structure CID 60854

Ziprasidone; 146939-27-7; Geodon ...

MW:: 412.900
MF:: C₂₁H₂₁ClN₄OS

IUPAC name:: 5-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-6-chlor...

Create Date:: 2005-06-24

CID:: 60854

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

Select item 6083512.

an image of a chemical structure CID 60835

duloxetine; 116539-59-4; (S)-Duloxetine ...

MW:: 297.400
MF:: C₁₈H₁₉NOS

IUPAC name:: (3S)-N-methyl-3-naphthalen-1-yloxy-3-thiophen-2-ylpropan-1-a...

Create Date:: 2005-06-24

CID:: 60835

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

Select item 5548313.

an image of a chemical structure CID 55483

Dopexamine; 86197-47-9; FPL 60278 ...

MW:: 356.500
MF:: C₂₂H₃₂N₂O₂

IUPAC name:: 4-[2-[6-(2-phenylethylamino)hexylamino]ethyl]benzene-1,2-dio...

Create Date:: 2005-08-08

CID:: 55483

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

Select item 5484114.

an image of a chemical structure CID 54841

Atomoxetine; 83015-26-3; Tomoxetine ...

MW:: 255.350
MF:: C₁₇H₂₁NO

IUPAC name:: (3R)-N-methyl-3-(2-methylphenoxy)-3-phenylpropan-1-amine

Create Date:: 2005-07-19

CID:: 54841

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

Select item 4381515.

an image of a chemical structure CID 43815

paroxetine; 61869-08-7; Paxil ...

MW:: 329.400
MF:: C₁₉H₂₀FNO₃

IUPAC name:: (3S,4R)-3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)...

Create Date:: 2005-06-08

CID:: 43815

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

Select item 573616.

an image of a chemical structure CID 5736

zotepine; 26615-21-4; Nipolept ...

MW:: 331.900
MF:: C₁₈H₁₈ClNOS

IUPAC name:: 2-(3-chlorobenzo[b][1]benzothiepin-5-yl)oxy-N,N-dimethyletha...

Create Date:: 2005-03-25

CID:: 5736

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

Select item 566617.

an image of a chemical structure CID 5666

viloxazine; 46817-91-8; Viloxazin ...

MW:: 237.290
MF:: C₁₃H₁₉NO₃

IUPAC name:: 2-[(2-ethoxyphenoxy)methyl]morpholine

Create Date:: 2005-03-25

CID:: 5666

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

Select item 556418.

an image of a chemical structure CID 5564

triclosan; 3380-34-5; 5-CHLORO-2-(2,4-DICHLOROPHENOXY)PHENOL ...

MW:: 289.500
MF:: C₁₂H₇Cl₃O₂

IUPAC name:: 5-chloro-2-(2,4-dichlorophenoxy)phenol

Create Date:: 2005-03-25

CID:: 5564

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

Select item 545319.

an image of a chemical structure CID 5453

thiotepa; 52-24-4; THIO-TEPA ...

MW:: 189.220
MF:: C₆H₁₂N₃PS

IUPAC name:: tris(aziridin-1-yl)-sulfanylidene-lambda5-phosphane

Create Date:: 2005-03-25

CID:: 5453

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

Select item 521020.

an image of a chemical structure CID 5210

sibutramine; 106650-56-0; Medaria ...

MW:: 279.800
MF:: C₁₇H₂₆ClN

IUPAC name:: 1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amin...

Create Date:: 2005-03-25

CID:: 5210

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

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Rule of 5 (29)
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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