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Volumn 17, Issue 10, 2015, Pages 600-607

Price-Focused Analysis of Commercially Available Building Blocks for Combinatorial Library Synthesis

Author keywords

building blocks; combinatorial library; cost; diversity; library design; price

Indexed keywords

AMINE; DYES, REAGENTS, INDICATORS, MARKERS AND BUFFERS;

EID: 84944326739     PISSN: 21568952     EISSN: None     Source Type: Journal    
DOI: 10.1021/acscombsci.5b00063     Document Type: Article
Times cited : (49)

References (21)
  • 1
    • 84955072980 scopus 로고    scopus 로고
    • Combinatorial Chemistry
    • Jung, G. Wiley-VCH Verlag GmbH: Weinheim, Germany
    • Tiebes, D. Combinatorial Chemistry. In Combinatorial Chemistry: Synthesis, Analysis, Screening; Jung, G., Ed.; Wiley-VCH Verlag GmbH: Weinheim, Germany, 1999; pp 1-34.
    • (1999) Combinatorial Chemistry: Synthesis, Analysis, Screening , pp. 1-34
    • Tiebes, D.1
  • 3
    • 0037468884 scopus 로고    scopus 로고
    • A comparison of physiochemical property profiles of development and marketed oral drugs
    • Wenlock, M. C.; Austin, R. P.; Barton, P.; Davis, A. M.; Leeson, P. D. A comparison of physiochemical property profiles of development and marketed oral drugs J. Med. Chem. 2003, 46, 1250-1256 10.1021/jm021053p
    • (2003) J. Med. Chem. , vol.46 , pp. 1250-1256
    • Wenlock, M.C.1    Austin, R.P.2    Barton, P.3    Davis, A.M.4    Leeson, P.D.5
  • 4
    • 35748934487 scopus 로고    scopus 로고
    • The influence of drug-like concepts on decision-making in medicinal chemistry
    • Leeson, P. D.; Springthorpe, B. The influence of drug-like concepts on decision-making in medicinal chemistry Nat. Rev. Drug Discovery 2007, 6, 881-890 10.1038/nrd2445
    • (2007) Nat. Rev. Drug Discovery , vol.6 , pp. 881-890
    • Leeson, P.D.1    Springthorpe, B.2
  • 5
    • 33746891508 scopus 로고    scopus 로고
    • GLARE: A new approach for filtering large reagent lists in combinatorial library design using product properties
    • Truchon, J. F.; Bayly, C. I. GLARE: a new approach for filtering large reagent lists in combinatorial library design using product properties J. Chem. Inf. Model. 2006, 46, 1536-1548 10.1021/ci0504871
    • (2006) J. Chem. Inf. Model. , vol.46 , pp. 1536-1548
    • Truchon, J.F.1    Bayly, C.I.2
  • 6
    • 77950571108 scopus 로고    scopus 로고
    • New substructure filters for removal of pan assay interference compounds (PAINS) from screening libraries and for their exclusion in bioassays
    • Baell, J. B.; Holloway, G. A. New substructure filters for removal of pan assay interference compounds (PAINS) from screening libraries and for their exclusion in bioassays J. Med. Chem. 2010, 53, 2719-2740 10.1021/jm901137j
    • (2010) J. Med. Chem. , vol.53 , pp. 2719-2740
    • Baell, J.B.1    Holloway, G.A.2
  • 7
    • 84870026354 scopus 로고    scopus 로고
    • Rules for identifying potentially reactive or promiscuous compounds
    • Bruns, R. F.; Watson, I. A. Rules for identifying potentially reactive or promiscuous compounds J. Med. Chem. 2012, 55, 9763-9772 10.1021/jm301008n
    • (2012) J. Med. Chem. , vol.55 , pp. 9763-9772
    • Bruns, R.F.1    Watson, I.A.2
  • 8
    • 71049126548 scopus 로고    scopus 로고
    • Escape from Flatland: Increasing Saturation as an Approach to Improving Clinical Success
    • Lovering, F.; Bikker, J.; Humblet, C. Escape from Flatland: Increasing Saturation as an Approach to Improving Clinical Success J. Med. Chem. 2009, 52, 6752-6756 10.1021/jm901241e
    • (2009) J. Med. Chem. , vol.52 , pp. 6752-6756
    • Lovering, F.1    Bikker, J.2    Humblet, C.3
  • 9
    • 84867774202 scopus 로고    scopus 로고
    • Plane of Best Fit: A Novel Method to Characterize the Three-Dimensionality of Molecules
    • Firth, N. C.; Brown, N.; Blagg, J. Plane of Best Fit: A Novel Method to Characterize the Three-Dimensionality of Molecules J. Chem. Inf. Model. 2012, 52, 2516-2525 10.1021/ci300293f
    • (2012) J. Chem. Inf. Model. , vol.52 , pp. 2516-2525
    • Firth, N.C.1    Brown, N.2    Blagg, J.3
  • 10
    • 80053928594 scopus 로고    scopus 로고
    • What do medicinal chemists actually make? A 50-year retrospective
    • Walters, W. P.; Green, J.; Weiss, J. R.; Murcko, M. A. What do medicinal chemists actually make? A 50-year retrospective J. Med. Chem. 2011, 54, 6405-6416 10.1021/jm200504p
    • (2011) J. Med. Chem. , vol.54 , pp. 6405-6416
    • Walters, W.P.1    Green, J.2    Weiss, J.R.3    Murcko, M.A.4
  • 11
    • 84944350122 scopus 로고    scopus 로고
    • European Lead Factory. (accessed Jan)
    • European Lead Factory. https://www.europeanleadfactory.eu/ (accessed Jan 2015).
    • (2015)
  • 12
    • 84944350123 scopus 로고    scopus 로고
    • Accelrys Available Chemical Directory (ACD)
    • Accelrys Available Chemical Directory (ACD). http://accelrys.com/products/pdf/available-chemicals-directory.pdf.
  • 13
    • 84944350124 scopus 로고    scopus 로고
    • eMolecules, Inc. Emolecules Plus database. (accessed Jan)
    • eMolecules, Inc. Emolecules Plus database. http://www.emolecules.com (accessed Jan 2015).
    • (2015)
  • 14
    • 74049124426 scopus 로고    scopus 로고
    • Estimation of synthetic accessibility score of drug-like molecules based on molecular complexity and fragment contributions
    • Ertl, P.; Schuffenhauer, A. Estimation of synthetic accessibility score of drug-like molecules based on molecular complexity and fragment contributions J. Cheminf. 2009, 1, 8 10.1186/1758-2946-1-8
    • (2009) J. Cheminf. , vol.1 , pp. 8
    • Ertl, P.1    Schuffenhauer, A.2
  • 15
    • 84924709740 scopus 로고    scopus 로고
    • Understanding Our Love Affair with p-Chlorophenyl: Present Day Implications from Historical Biases of Reagent Selection
    • Brown, D. B.; Gagnon, M. M.; Boström, J. Understanding Our Love Affair with p-Chlorophenyl: Present Day Implications from Historical Biases of Reagent Selection J. Med. Chem. 2015, 58, 2390 10.1021/jm501894t
    • (2015) J. Med. Chem. , vol.58 , pp. 2390
    • Brown, D.B.1    Gagnon, M.M.2    Boström, J.3
  • 16
    • 84920493192 scopus 로고    scopus 로고
    • Chemical space is big. Really big
    • Lowe, D. Chemical space is big. Really big MedChemComm 2015, 6, 12 10.1039/C4MD90045F
    • (2015) MedChemComm , vol.6 , pp. 12
    • Lowe, D.1
  • 17
    • 84944318033 scopus 로고    scopus 로고
    • ChemAxon Kft. Budapest, Hungary
    • JChem; ChemAxon Kft.: Budapest, Hungary; http://www.chemaxon.com.
    • JChem
  • 18
    • 84944350125 scopus 로고    scopus 로고
    • RDKit: Open-source cheminformatics
    • RDKit: Open-source cheminformatics. http://www.rdkit.org.
  • 20
    • 84916593737 scopus 로고    scopus 로고
    • The FPS fingerprint format and chemfp toolkit
    • Dalke, A. The FPS fingerprint format and chemfp toolkit J. Cheminf. 2013, 5, P36 10.1186/1758-2946-5-S1-P36
    • (2013) J. Cheminf. , vol.5 , pp. P36
    • Dalke, A.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.