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212779-48-1,MFCD02179196
Catalog No.:AA00BCGX

212779-48-1 | Ng 52

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1mg
≥98%
in stock  
$89.00   $62.00
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100mg
98%
in stock  
$216.00   $151.00
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00BCGX
Chemical Name:
Ng 52
CAS Number:
212779-48-1
Molecular Formula:
C16H19ClN6O
Molecular Weight:
346.8147
MDL Number:
MFCD02179196
SMILES:
OCCNc1nc(Nc2cccc(c2)Cl)c2c(n1)n(cn2)C(C)C
Properties
Computed Properties
 
Complexity:
401  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
6  
XLogP3:
2.9  

Literature

Title: A broad activity screen in support of a chemogenomic map for kinase signalling research and drug discovery.

Journal: The Biochemical journal 20130415

Title: Design, Synthesis and Biological Evaluation of a Series of Novel Axl Kinase Inhibitors.

Journal: ACS medicinal chemistry letters 20111208

Title: Comprehensive assay of kinase catalytic activity reveals features of kinase inhibitor selectivity.

Journal: Nature biotechnology 20111101

Title: Identification of new inhibitors of protein kinase R guided by statistical modeling.

Journal: Bioorganic & medicinal chemistry letters 20110701

Title: Structural insights into the inhibited states of the Mer receptor tyrosine kinase.

Journal: Journal of structural biology 20090201

Title: A systematic interaction map of validated kinase inhibitors with Ser/Thr kinases.

Journal: Proceedings of the National Academy of Sciences of the United States of America 20071218

Title: Structural classification of protein kinases using 3D molecular interaction field analysis of their ligand binding sites: target family landscapes.

Journal: Journal of medicinal chemistry 20020606

Title: Exploiting chemical libraries, structure, and genomics in the search for kinase inhibitors.

Journal: Science (New York, N.Y.) 19980724

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SDS
Tags:212779-48-1 Molecular Formula|212779-48-1 MDL|212779-48-1 SMILES|212779-48-1 Ng 52