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Volumn 17, Issue 3, 2008, Pages 285-292

Analysis relationships between pharmacokinetic parameters in silico/in vivo of selected antiviral drugs based on structural analysis

Author keywords

Bioavailability; CLogP; Pharmacokinetics; PSA; Rimantadine

Indexed keywords

AMANTADINE; ANTIVIRUS AGENT; CARBOXYOSELTAMIVIR; OSELTAMIVIR; RIMANTADINE; ZANAMIVIR;

EID: 48049112066     PISSN: 1230025X     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article
Times cited : (4)

References (18)
  • 1
    • 16244386216 scopus 로고    scopus 로고
    • Comparison of the octanol/water partition coefficients calculated by CLogP, ACDLogP and KowWin to experimentally determined values
    • Machatha SG, Yalkowsky SH: Comparison of the octanol/water partition coefficients calculated by CLogP, ACDLogP and KowWin to experimentally determined values. Int J Pharm 2005, 294, 185-92.
    • (2005) Int J Pharm , vol.294 , pp. 185-192
    • Machatha, S.G.1    Yalkowsky, S.H.2
  • 2
    • 0034609833 scopus 로고    scopus 로고
    • Fast calculation of molecular polar surface area as a sum of fragment-based contributions and its application to the prediction of drug transport properties
    • Ertl P, Rohde B, Selzer P: Fast calculation of molecular polar surface area as a sum of fragment-based contributions and its application to the prediction of drug transport properties. J Med Chem 2000, 5, 3714-3717.
    • (2000) J Med Chem , vol.5 , pp. 3714-3717
    • Ertl, P.1    Rohde, B.2    Selzer, P.3
  • 3
    • 0344984493 scopus 로고    scopus 로고
    • Web-based cheminformatics and molecular property prediction tools supporting drug design and development at Novartis
    • Ertl P, Muhlbacher J, Rohde B, Selzer P: Web-based cheminformatics and molecular property prediction tools supporting drug design and development at Novartis. SAR QSAR Environ Res 2003, 14, 321-328.
    • (2003) SAR QSAR Environ Res , vol.14 , pp. 321-328
    • Ertl, P.1    Muhlbacher, J.2    Rohde, B.3    Selzer, P.4
  • 4
    • 0037362041 scopus 로고    scopus 로고
    • Cheminformatics analysis of organic substituents: Identification of the most common substituents, calculation of substituent properties, and automatic identification of drug-like bioisosteric groups
    • Ertl P: Cheminformatics analysis of organic substituents: identification of the most common substituents, calculation of substituent properties, and automatic identification of drug-like bioisosteric groups. J Chem Inf Comput Sci 2003, 43, 374-380.
    • (2003) J Chem Inf Comput Sci , vol.43 , pp. 374-380
    • Ertl, P.1
  • 6
    • 0021349111 scopus 로고
    • Molecular structures: Perception, autocorrelation descriptor and QSAR studies. System of atomic contributions for the calculation of the n-octanol/water coefficients
    • Broto P, Moreau G, VanDycke C: Molecular structures: perception, autocorrelation descriptor and QSAR studies. System of atomic contributions for the calculation of the n-octanol/water coefficients. Eur J Med Chem 1984, 19, 71-78.
    • (1984) Eur J Med Chem , vol.19 , pp. 71-78
    • Broto, P.1    Moreau, G.2    VanDycke, C.3
  • 7
    • 0036010699 scopus 로고    scopus 로고
    • Subcellular pharmacokinetics and its potential for library focusing
    • Balaz S, Lukacova V: Subcellular pharmacokinetics and its potential for library focusing. J Mol Graph Model 2002, 20, 479-490.
    • (2002) J Mol Graph Model , vol.20 , pp. 479-490
    • Balaz, S.1    Lukacova, V.2
  • 8
    • 0034861906 scopus 로고    scopus 로고
    • Prediction of intestinal absorption and blood brain barrier penetration by computational methods
    • Clark DE: Prediction of intestinal absorption and blood brain barrier penetration by computational methods. Comb Chem High Throughput Screen 2001, 4, 477-496.
    • (2001) Comb Chem High Throughput Screen , vol.4 , pp. 477-496
    • Clark, D.E.1
  • 9
    • 0036284090 scopus 로고    scopus 로고
    • Versatile Program To Convert, Handle And Visualize Molecular Structure on Windows-Based Pcs
    • Pedretti A, Villa L, Vistoli G: Vega A Versatile Program To Convert, Handle And Visualize Molecular Structure on Windows-Based Pcs. J Mol Graph 2002, 21, 47-49.
    • (2002) J Mol Graph , vol.21 , pp. 47-49
    • Pedretti, A.1    Villa, L.2    Vistoli, G.3    Vega, A.4
  • 10
    • 4043162793 scopus 로고    scopus 로고
    • Vega - An Open Platform To Develop Chemo-Bio-Informatics Applications, Using Plug-In Architecture And Script Programming
    • Pedretti A, Villa L, Vistoli G: Vega - An Open Platform To Develop Chemo-Bio-Informatics Applications, Using Plug-In Architecture And Script Programming. J Comput Aided Mol Des 2004, 18, 167-173.
    • (2004) J Comput Aided Mol Des , vol.18 , pp. 167-173
    • Pedretti, A.1    Villa, L.2    Vistoli, G.3
  • 11
    • 9444296174 scopus 로고
    • Highly discriminating distance-based topological index
    • Balaban AT: Highly discriminating distance-based topological index. Chem Phys Lett 1982, 89, 399-404.
    • (1982) Chem Phys Lett , vol.89 , pp. 399-404
    • Balaban, A.T.1
  • 12
    • 84961488478 scopus 로고
    • Topological indices based on topological distances in molecular graphs
    • Balaban AT: Topological indices based on topological distances in molecular graphs. Pure Appl Chem 1983, 55, 199-206.
    • (1983) Pure Appl Chem , vol.55 , pp. 199-206
    • Balaban, A.T.1
  • 13
    • 0031024171 scopus 로고    scopus 로고
    • Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings
    • Lipinski CA, Lombardo F, Dominy BW, Feeney PJ: Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings. Adv Drug Del Rev 1997, 23, 3-25.
    • (1997) Adv Drug Del Rev , vol.23 , pp. 3-25
    • Lipinski, C.A.1    Lombardo, F.2    Dominy, B.W.3    Feeney, P.J.4
  • 14
    • 0034461768 scopus 로고    scopus 로고
    • Drug-like properties and the causes of poor solubility and poor permeability
    • Lipinski CA: Drug-like properties and the causes of poor solubility and poor permeability. J Pharmacol Toxicol Methods 2000, 44, 235-249.
    • (2000) J Pharmacol Toxicol Methods , vol.44 , pp. 235-249
    • Lipinski, C.A.1
  • 15
    • 0036891999 scopus 로고    scopus 로고
    • Single-Mode compound retrieval for QSAR, QSPR data sets, and batch mode exact structure searching
    • Lipinski CA: Single-Mode compound retrieval for QSAR, QSPR data sets, and batch mode exact structure searching. J Pharm Sci 2002, 91, 2470-2472.
    • (2002) J Pharm Sci , vol.91 , pp. 2470-2472
    • Lipinski, C.A.1
  • 16
    • 0021878483 scopus 로고
    • Comparative single-dose pharmacokinetics of amantadine hydrochloride and rimantadine hydrochloride in young and elderly adults
    • Hayden FG, Minocha A, Spyker DA, Hoffman HE: Comparative single-dose pharmacokinetics of amantadine hydrochloride and rimantadine hydrochloride in young and elderly adults. Antimicrob Agents Chemother 1985, 28, 216-221.
    • (1985) Antimicrob Agents Chemother , vol.28 , pp. 216-221
    • Hayden, F.G.1    Minocha, A.2    Spyker, D.A.3    Hoffman, H.E.4
  • 18
    • 0023507174 scopus 로고
    • Relative bioavailability of rimantadine HCl tablet and syrup formulations in healthy subjects
    • Wills RJ, Choma N, Buonpane G, Lin A, Keigher N: Relative bioavailability of rimantadine HCl tablet and syrup formulations in healthy subjects. J Pharm Sci 1987, 76(12), 886-888.
    • (1987) J Pharm Sci , vol.76 , Issue.12 , pp. 886-888
    • Wills, R.J.1    Choma, N.2    Buonpane, G.3    Lin, A.4    Keigher, N.5


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.