Compounds for PubChem BioAssay (Select 1542143) - PubChem Compound - NCBI

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Select item 1555164311.

an image of a chemical structure CID 155516431

CHEMBL4443138; BDBM50509659

MW:: 417.900
MF:: C₂₂H₂₄ClNO₅

IUPAC name:: (4S)-4-(3-carboxypropanoylamino)-5-[4-(3-chlorophenyl)phenyl...

Create Date:: 2021-02-17

CID:: 155516431

Summary Similar Compounds Same Parent, Connectivity

Select item 1555139512.

an image of a chemical structure CID 155513951

CHEMBL4439270; BDBM50509648

MW:: 397.500
MF:: C₂₃H₂₇NO₅

IUPAC name:: (4R)-4-(3-carboxypropanoylamino)-2,2-dimethyl-5-(4-phenylphe...

Create Date:: 2021-02-17

CID:: 155513951

Summary Similar Compounds Same Parent, Connectivity

Select item 687497923.

an image of a chemical structure CID 68749792

CHEMBL4442804; SCHEMBL3700453; OFCQCSHBABYJSE-LIRRHRJNSA-N ...

MW:: 417.900
MF:: C₂₂H₂₄ClNO₅

IUPAC name:: (2S,4S)-4-(3-carboxypropanoylamino)-5-[4-(3-chlorophenyl)phe...

Create Date:: 2012-11-30

CID:: 68749792

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 596079254.

an image of a chemical structure CID 59607925

CHEMBL4471166; SCHEMBL2872634; BDBM50509646

MW:: 380.400
MF:: C₂₁H₂₀N₂O₅

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(2-cyanophenyl)phenyl]propan-2-yl]am...

Create Date:: 2012-08-20

CID:: 59607925

Summary Similar Compounds Same Parent, Connectivity

Select item 596078735.

an image of a chemical structure CID 59607873

CHEMBL4443565; SCHEMBL2875653; BDBM50509667 ...

MW:: 439.400
MF:: C₂₁H₂₀F₃NO₆

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-[2-(trifluoromethoxy)phenyl]phenyl]p...

Create Date:: 2012-08-20

CID:: 59607873

Summary Similar Compounds Same Parent, Connectivity

Select item 596078556.

an image of a chemical structure CID 59607855

CHEMBL4557208; SCHEMBL2877474; BDBM50509652

MW:: 369.400
MF:: C₂₁H₂₃NO₅

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(3-methylphenyl)phenyl]propan-2-yl]a...

Create Date:: 2012-08-20

CID:: 59607855

Summary Similar Compounds Same Parent, Connectivity

Select item 596078537.

an image of a chemical structure CID 59607853

CHEMBL4547205; SCHEMBL2873035; BDBM50509663 ...

MW:: 423.400
MF:: C₂₁H₂₀F₃NO₅

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-[3-(trifluoromethyl)phenyl]phenyl]pr...

Create Date:: 2012-08-20

CID:: 59607853

Summary Similar Compounds Same Parent, Connectivity

Select item 596078178.

an image of a chemical structure CID 59607817

CHEMBL4559586; SCHEMBL12975352; BDBM50509651 ...

MW:: 423.400
MF:: C₂₁H₂₀F₃NO₅

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-[2-(trifluoromethyl)phenyl]phenyl]pr...

Create Date:: 2012-08-20

CID:: 59607817

Summary Similar Compounds Same Parent, Connectivity

Select item 596078049.

an image of a chemical structure CID 59607804

CHEMBL4548017; SCHEMBL2875848; BDBM50509657

MW:: 419.900
MF:: C₂₁H₂₂ClNO₆

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(3-chloro-2-methoxyphenyl)phenyl]pro...

Create Date:: 2012-08-20

CID:: 59607804

Summary Similar Compounds Same Parent, Connectivity

Select item 5960779710.

an image of a chemical structure CID 59607797

CHEMBL4458213; SCHEMBL2873388; BDBM50509665

MW:: 389.800
MF:: C₂₀H₂₀ClNO₅

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(4-chlorophenyl)phenyl]propan-2-yl]a...

Create Date:: 2012-08-20

CID:: 59607797

Summary Similar Compounds Same Parent, Connectivity

Select item 5960779311.

an image of a chemical structure CID 59607793

CHEMBL4518025; SCHEMBL12975341; BDBM50509653

MW:: 385.400
MF:: C₂₁H₂₃NO₆

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(3-methoxyphenyl)phenyl]propan-2-yl]...

Create Date:: 2012-08-20

CID:: 59607793

Summary Similar Compounds Same Parent, Connectivity

Select item 5960775012.

an image of a chemical structure CID 59607750

CHEMBL4448802; SCHEMBL2872642; BDBM50509654 ...

MW:: 439.400
MF:: C₂₁H₂₀F₃NO₆

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-[3-(trifluoromethoxy)phenyl]phenyl]p...

Create Date:: 2012-08-20

CID:: 59607750

Summary Similar Compounds Same Parent, Connectivity

Select item 5960774813.

an image of a chemical structure CID 59607748

SCHEMBL2869988; CHEMBL3676140; BDBM130354 ...

MW:: 373.400
MF:: C₂₀H₂₀FNO₅

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(3-fluorophenyl)phenyl]propan-2-yl]a...

Create Date:: 2012-08-20

CID:: 59607748

Summary Similar Compounds Same Parent, Connectivity

Select item 5960774114.

an image of a chemical structure CID 59607741

4-[[(2~{R})-1-[4-(3-chlorophenyl)phenyl]-4-oxidanyl-4-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid; SCHEMBL2878447; CHEMBL3676150 ...

MW:: 389.800
MF:: C₂₀H₂₀ClNO₅

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(3-chlorophenyl)phenyl]propan-2-yl]a...

Create Date:: 2012-08-20

CID:: 59607741

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 5960772315.

an image of a chemical structure CID 59607723

CHEMBL4459630; SCHEMBL2873441; BDBM50509658

MW:: 407.800
MF:: C₂₀H₁₉ClFNO₅

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(3-chloro-5-fluorophenyl)phenyl]prop...

Create Date:: 2012-08-20

CID:: 59607723

Summary Similar Compounds Same Parent, Connectivity

Select item 5960770816.

an image of a chemical structure CID 59607708

SCHEMBL2870419; CHEMBL3676144; BDBM130359 ...

MW:: 419.900
MF:: C₂₁H₂₂ClNO₆

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(5-chloro-2-methoxyphenyl)phenyl]pro...

Create Date:: 2012-08-20

CID:: 59607708

Summary Similar Compounds Same Parent, Connectivity

Select item 5960769317.

an image of a chemical structure CID 59607693

CHEMBL4475874; SCHEMBL2875457; BDBM50509662

MW:: 370.400
MF:: C₂₀H₂₂N₂O₅

IUPAC name:: 4-[[(2R)-1-[4-(3-aminophenyl)phenyl]-3-carboxypropan-2-yl]am...

Create Date:: 2012-08-20

CID:: 59607693

Summary Similar Compounds Same Parent, Connectivity

Select item 5960768418.

an image of a chemical structure CID 59607684

CHEMBL4592467; SCHEMBL2873833; BDBM50509650

MW:: 369.400
MF:: C₂₁H₂₃NO₅

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(2-methylphenyl)phenyl]propan-2-yl]a...

Create Date:: 2012-08-20

CID:: 59607684

Summary Similar Compounds Same Parent, Connectivity

Select item 5960768119.

an image of a chemical structure CID 59607681

CHEMBL4568947; SCHEMBL2878369; BDBM50509656

MW:: 400.400
MF:: C₂₀H₂₀N₂O₇

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(3-nitrophenyl)phenyl]propan-2-yl]am...

Create Date:: 2012-08-20

CID:: 59607681

Summary Similar Compounds Same Parent, Connectivity

Select item 5960767120.

an image of a chemical structure CID 59607671

CHEMBL4434901; SCHEMBL2875327; BDBM50509660

MW:: 373.400
MF:: C₂₀H₂₀FNO₅

IUPAC name:: 4-[[(2R)-1-carboxy-3-[4-(2-fluorophenyl)phenyl]propan-2-yl]a...

Create Date:: 2012-08-20

CID:: 59607671

Summary Similar Compounds Same Parent, Connectivity

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Chemical Properties

Rule of 5 (31)
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 (31)
Compounds identified as active in screening experiments

BioAssays, Tested (31)
Compounds identified as tested in screening experiments

Protein 3D Structures (2)
Compounds bound to proteins in atructure biology experiments

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Chemical Vendors (1)

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Compounds for PubChem BioAssay (Select 1542143) (31)
PubChem Compound
Taxonomy Links for GEO Profiles (Select 109379455) (1)
Taxonomy
txid54126[orgn] AND "isolate RSA110"[All Fields] (2)
Protein
Aldh7a1 aldehyde dehydrogenase family 7, member A1 [Mus musculus]
Aldh7a1 aldehyde dehydrogenase family 7, member A1 [Mus musculus]
Gene ID:110695

Gene
Gene Links for GEO Profiles (Select 105870633) (1)
Gene

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