Compounds, Active for PubChem BioAssay (Select 1801848) - PubChem Compound - NCBI

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Items: 20

Select item 1231315981.

an image of a chemical structure CID 123131598

LOX inhibitor, 13; SCHEMBL18347218; BDBM190652 ...

MW:: 283.400
MF:: C₁₉H₂₅NO

IUPAC name:: 4-hexyl-1-[(2-methylphenyl)methyl]pyridin-2-one

Create Date:: 2016-12-29

CID:: 123131598

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 1231315972.

an image of a chemical structure CID 123131597

LOX inhibitor, 5; BDBM190651; PT113

MW:: 288.400
MF:: C₁₈H₂₁FO₂

IUPAC name:: 2-(2-fluorophenoxy)-5-hexylphenol

Create Date:: 2016-12-29

CID:: 123131597

Summary Similar Compounds Same Parent, Connectivity

Select item 1214937813.

an image of a chemical structure CID 121493781

SCHEMBL18347247; BDBM190660; PT157

MW:: 300.400
MF:: C₁₈H₂₄N₂O₂

IUPAC name:: 5-(4-aminophenoxy)-2-hexyl-1-methylpyridin-4-one

Create Date:: 2016-08-19

CID:: 121493781

Summary Similar Compounds Same Parent, Connectivity

Select item 1214937804.

an image of a chemical structure CID 121493780

SCHEMBL18347230; BDBM190659; PT156

MW:: 330.400
MF:: C₁₈H₂₂N₂O₄

IUPAC name:: 2-hexyl-1-methyl-5-(4-nitrophenoxy)pyridin-4-one

Create Date:: 2016-08-19

CID:: 121493780

Summary Similar Compounds Same Parent, Connectivity

Select item 1214937795.

an image of a chemical structure CID 121493779

SCHEMBL18347224; BDBM190657; PT425

MW:: 284.400
MF:: C₁₈H₂₄N₂O

IUPAC name:: 1-[(4-aminophenyl)methyl]-4-hexylpyridin-2-one

Create Date:: 2016-08-19

CID:: 121493779

Summary Similar Compounds Same Parent, Connectivity

Select item 1214937786.

an image of a chemical structure CID 121493778

SCHEMBL18347245; BDBM190656; PT424

MW:: 314.400
MF:: C₁₈H₂₂N₂O₃

IUPAC name:: 4-hexyl-1-[(4-nitrophenyl)methyl]pyridin-2-one

Create Date:: 2016-08-19

CID:: 121493778

Summary Similar Compounds Same Parent, Connectivity

Select item 1214937777.

an image of a chemical structure CID 121493777

SCHEMBL18347228; BDBM190655; PT179

MW:: 269.400
MF:: C₁₈H₂₃NO

IUPAC name:: 1-benzyl-4-hexylpyridin-2-one

Create Date:: 2016-08-19

CID:: 121493777

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 863023648.

an image of a chemical structure CID 86302364

2-(2-Chloranylphenoxy)-5-Hexyl-Phenol; PT91; CHEMBL4162007 ...

MW:: 304.800
MF:: C₁₈H₂₁ClO₂

IUPAC name:: 2-(2-chlorophenoxy)-5-hexylphenol

Create Date:: 2014-12-31

CID:: 86302364

Summary Similar Compounds Same Parent, Connectivity

Select item 734376039.

an image of a chemical structure CID 73437603

5-(4-Amino-2-Methylphenoxy)-2-Hexyl-4-Hydroxy-1-Methylpyridinium; 1S5; CHEMBL4172664 ...

MW:: 314.400
MF:: C₁₉H₂₆N₂O₂

IUPAC name:: 5-(4-amino-2-methylphenoxy)-2-hexyl-1-methylpyridin-4-one

Create Date:: 2014-04-17

CID:: 73437603

Summary Similar Compounds Same Parent, Connectivity

Select item 5476533410.

an image of a chemical structure CID 54765334

1-(3-Amino-2-Methylbenzyl)-4-Hexylpyridin-2(1h)-One; AEW; SCHEMBL18347226 ...

MW:: 298.400
MF:: C₁₉H₂₆N₂O

IUPAC name:: 1-[(3-amino-2-methylphenyl)methyl]-4-hexylpyridin-2-one

Create Date:: 2012-01-18

CID:: 54765334

Summary Similar Compounds Same Parent, Connectivity

Select item 5476533311.

an image of a chemical structure CID 54765333

1-(2-Chlorobenzyl)-4-Hexylpyridin-2(1h)-One; SCHEMBL18347221; BDBM190653 ...

MW:: 303.800
MF:: C₁₈H₂₂ClNO

IUPAC name:: 1-[(2-chlorophenyl)methyl]-4-hexylpyridin-2-one

Create Date:: 2012-01-18

CID:: 54765333

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 4445012412.

an image of a chemical structure CID 44450124

5-hexyl-2-(4-nitrophenoxy)phenol; CHEMBL264417; JA1 ...

MW:: 315.400
MF:: C₁₈H₂₁NO₄

IUPAC name:: 5-hexyl-2-(4-nitrophenoxy)phenol

Create Date:: 2009-11-19

CID:: 44450124

Summary Similar Compounds Same Parent, Connectivity

Select item 4445012213.

an image of a chemical structure CID 44450122

5-hexyl-2-(2-nitrophenoxy)phenol; CHEMBL264415; BDBM50373355 ...

MW:: 315.400
MF:: C₁₈H₂₁NO₄

IUPAC name:: 5-hexyl-2-(2-nitrophenoxy)phenol

Create Date:: 2009-11-19

CID:: 44450122

Summary Similar Compounds Same Parent, Connectivity

Select item 4445009414.

an image of a chemical structure CID 44450094

2-(2-Azanylphenoxy)-5-Hexyl-Phenol; CHEMBL264434; 2-(2-aminophenoxy)-5-hexylphenol ...

MW:: 285.400
MF:: C₁₈H₂₃NO₂

IUPAC name:: 2-(2-aminophenoxy)-5-hexylphenol

Create Date:: 2009-11-19

CID:: 44450094

Summary Similar Compounds Same Parent, Connectivity

Select item 4445009115.

an image of a chemical structure CID 44450091

CHEMBL264175; BDBM50373347; PD179872

MW:: 285.400
MF:: C₁₈H₂₃NO₂

IUPAC name:: 2-(4-aminophenoxy)-5-hexylphenol

Create Date:: 2009-11-19

CID:: 44450091

Summary Similar Compounds Same Parent, Connectivity

Select item 1672711016.

an image of a chemical structure CID 16727110

5-Hexyl-2-(2-Methylphenoxy)phenol; CHEMBL1236225; TCU ...

MW:: 284.400
MF:: C₁₉H₂₄O₂

IUPAC name:: 5-hexyl-2-(2-methylphenoxy)phenol

Create Date:: 2007-09-10

CID:: 16727110

Summary Similar Compounds Same Parent, Connectivity

Select item 1606141717.

an image of a chemical structure CID 16061417

2-Phenoxy-5-Propyl-Phenol; PT02; PV4 ...

MW:: 228.290
MF:: C₁₅H₁₆O₂

IUPAC name:: 2-phenoxy-5-propylphenol

Create Date:: 2007-05-22

CID:: 16061417

Summary Similar Compounds Same Parent, Connectivity

Select item 527497918.

an image of a chemical structure CID 5274979

5-OCTYL-2-PHENOXYPHENOL; 5-Octyl-2-phenoxy-phenol; CHEMBL505886 ...

MW:: 298.400
MF:: C₂₀H₂₆O₂

IUPAC name:: 5-octyl-2-phenoxyphenol

Create Date:: 2005-10-07

CID:: 5274979

Summary Similar Compounds Same Parent, Connectivity

Select item 527497719.

an image of a chemical structure CID 5274977

5-hexyl-2-phenoxyphenol; 5-Hexyl-2-phenoxy-phenol; 6PP ...

MW:: 270.400
MF:: C₁₈H₂₂O₂

IUPAC name:: 5-hexyl-2-phenoxyphenol

Create Date:: 2005-10-07

CID:: 5274977

Summary Similar Compounds Same Parent, Connectivity

Select item 527497620.

an image of a chemical structure CID 5274976

5-PENTYL-2-PHENOXYPHENOL; 5-Pentyl-2-phenoxy-phenol; 5PP ...

MW:: 256.340
MF:: C₁₇H₂₀O₂

IUPAC name:: 5-pentyl-2-phenoxyphenol

Create Date:: 2005-10-07

CID:: 5274976

Summary Similar Compounds Same Parent, Connectivity

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Chemical Properties

Rule of 5 (10)
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 (20)
Compounds identified as active in screening experiments

BioAssays, Tested (20)
Compounds identified as tested in screening experiments

Protein 3D Structures (10)
Compounds bound to proteins in atructure biology experiments

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Chemical Vendors (4)

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SRA
MAG: Anaerovibrio sp. isolate SUG1599 k141_207229, whole genome shotgun sequence
MAG: Anaerovibrio sp. isolate SUG1599 k141_207229, whole genome shotgun sequence
gi|2544429213|ref|NZ_JAQXWZ01000012 gnl|WGS:NZ_JAQXWZ01|k141_207229

Nucleotide

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