-
1
-
-
0035289779
-
Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings
-
Lipinski, C.A., Lombardo, F., Dominy, B.W. and Feeney, P.J. (2001) Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings. Advanced Drug Delivery Reviews, 46, 3-26.
-
(2001)
Advanced Drug Delivery Reviews
, vol.46
, pp. 3-26
-
-
Lipinski, C.A.1
Lombardo, F.2
Dominy, B.W.3
Feeney, P.J.4
-
2
-
-
0035150465
-
High throughput physicochemical profiling for drug discovery
-
Kerns, E. (2001) High throughput physicochemical profiling for drug discovery. Journal of Pharmaceutical Sciences, 90 (11), 1838-1858.
-
(2001)
Journal of Pharmaceutical Sciences
, vol.90
, Issue.11
, pp. 1838-1858
-
-
Kerns, E.1
-
3
-
-
33646115186
-
Biological assay challenges from compound solubility: strategies for bioassay optimisation
-
Di, L. and Kerns, E.H. (2006) Biological assay challenges from compound solubility: strategies for bioassay optimisation. Drug Discovery Today, 11 (9-10), 446-451.
-
(2006)
Drug Discovery Today
, vol.11
, Issue.9-10
, pp. 446-451
-
-
Di, L.1
Kerns, E.H.2
-
4
-
-
0037061628
-
A common mechanism underlying promiscuous inhibitors from virtual and high-throughput screening
-
McGovern, S.L., Caselli, E., Grigorieff, N. and Shoichet, B.K. (2002) A common mechanism underlying promiscuous inhibitors from virtual and high-throughput screening. Journal ofMedicinal Chemistry, 45, 1712-1722.
-
(2002)
Journal ofMedicinal Chemistry
, vol.45
, pp. 1712-1722
-
-
McGovern, S.L.1
Caselli, E.2
Grigorieff, N.3
Shoichet, B.K.4
-
5
-
-
0035953319
-
Property-based design: optimization of drug absorption and pharmacokinetics
-
van de Waterbeemd, H., Smith, D.A., Beaumont, K. and Walker, D.K. (2001) Property-based design: optimization of drug absorption and pharmacokinetics. Journal ofMedicinal Chemistry, 44, 1-21.
-
(2001)
Journal ofMedicinal Chemistry
, vol.44
, pp. 1-21
-
-
van de Waterbeemd, H.1
Smith, D.A.2
Beaumont, K.3
Walker, D.K.4
-
6
-
-
14144252561
-
Effect ofliquid volume and food intake on the absolute bioavailability of danazol, a poorly soluble drug
-
Sunesen, V.H., Vedelsdal, R., Kristensen, H.G., Christrup, L. and Mullertz, A. (2005) Effect ofliquid volume and food intake on the absolute bioavailability of danazol, a poorly soluble drug. European Journal of Pharmaceutical Sciences, 24, 297-303.
-
(2005)
European Journal of Pharmaceutical Sciences
, vol.24
, pp. 297-303
-
-
Sunesen, V.H.1
Vedelsdal, R.2
Kristensen, H.G.3
Christrup, L.4
Mullertz, A.5
-
7
-
-
34249037098
-
Predicting effect of food on extent of drug absorption based on physicochemical properties
-
Gu, C.H., Li, H., Levons, J., Lentz, K., Gandhi, R.B., Raghavan, K. and Smith, R.L. (2007) Predicting effect of food on extent of drug absorption based on physicochemical properties. Pharmaceutical Research, 24 (6), 1118-1130.
-
(2007)
Pharmaceutical Research
, vol.24
, Issue.6
, pp. 1118-1130
-
-
Gu, C.H.1
Li, H.2
Levons, J.3
Lentz, K.4
Gandhi, R.B.5
Raghavan, K.6
Smith, R.L.7
-
8
-
-
33947174194
-
An integrated early formulation strategy - from hit evaluation to preclinical candidate profiling
-
Mass, J., Kamm, W. and Hauck, G. (2007) An integrated early formulation strategy - from hit evaluation to preclinical candidate profiling. European Journal ofPharmaceutics and Biopharmaceutics, 66, 1-10.
-
(2007)
European Journal ofPharmaceutics and Biopharmaceutics
, vol.66
, pp. 1-10
-
-
Mass, J.1
Kamm, W.2
Hauck, G.3
-
9
-
-
36549033310
-
Pharmaceutical R&D in the spotlight: why is there still unmet medical need?
-
Schmid, E.F. and Smith, D.A. (2007) Pharmaceutical R&D in the spotlight: why is there still unmet medical need? Drug Discovery Today, 12, 998-1006.
-
(2007)
Drug Discovery Today
, vol.12
, pp. 998-1006
-
-
Schmid, E.F.1
Smith, D.A.2
-
10
-
-
13244293644
-
a
-
(eds H. van de Waterbeemd, H. Lennernas and P. Artursson), Wiley-VCH Verlag GmbH, Weinheim
-
a, in Drug Bioavailability. Methods and Principles in Medicinal Chemistry, Vol. 8 (eds H. van de Waterbeemd, H. Lennernas and P. Artursson), Wiley-VCH Verlag GmbH, Weinheim, pp. 21-43.
-
(2007)
Drug Bioavailability. Methods and Principles in Medicinal Chemistry
, vol.8
, pp. 21-43
-
-
Comer, J.E.A.1
-
11
-
-
34548032742
-
Salt formation to improve drug solubility
-
Serajuddin, A.T.M. (2007) Salt formation to improve drug solubility. Advanced Drug Delivery Reviews, 59, 603-616.
-
(2007)
Advanced Drug Delivery Reviews
, vol.59
, pp. 603-616
-
-
Serajuddin, A.T.M.1
-
12
-
-
36849049288
-
Development of a high throughput equilibrium solubility assay using miniaturized shake-flask method in early drug discovery
-
Zhou, L., Yang, L., Tilton, S. and Wang, J. (2007) Development of a high throughput equilibrium solubility assay using miniaturized shake-flask method in early drug discovery. Journal ofPharmaceutical Sciences, 96 (11), 3052-3071.
-
(2007)
Journal ofPharmaceutical Sciences
, vol.96
, Issue.11
, pp. 3052-3071
-
-
Zhou, L.1
Yang, L.2
Tilton, S.3
Wang, J.4
-
13
-
-
0035069173
-
Comparison ofchromatographic and spectroscopic methods used to rank compounds for aqueous solubility
-
Pan, L., Ho, Q., Tsutsui, K. and Takahashi, L. (2001) Comparison ofchromatographic and spectroscopic methods used to rank compounds for aqueous solubility. Journal ofPharmaceutical Sciences, 90 (4), 521-529.
-
(2001)
Journal ofPharmaceutical Sciences
, vol.90
, Issue.4
, pp. 521-529
-
-
Pan, L.1
Ho, Q.2
Tsutsui, K.3
Takahashi, L.4
-
14
-
-
33748678161
-
Integration ofa rapid automated solubility classification into early validation of hits obtained by high throughput screening
-
Fligge, T.A. and Schuler, A. (2006) Integration ofa rapid automated solubility classification into early validation of hits obtained by high throughput screening. Journal ofPharmaceutical and Biomedical Analysis, 42, 449-454.
-
(2006)
Journal ofPharmaceutical and Biomedical Analysis
, vol.42
, pp. 449-454
-
-
Fligge, T.A.1
Schuler, A.2
-
15
-
-
10644235575
-
Streamlined systemfor purifying and quantifying a diverse library of compounds and the effect of compound concentration measurements on the accurate interpretation ofbiological assay results
-
Popa-Burke, I.G., Issakova, O., Arroway, J. D., Bernasconi, P., Chen, M., Coudurier, L., Galasinski, S., Jadhav, A.P., Janzen, W.P., Lagasca, D., Liu, D., Lewis, R.S., Mohney, R.P., Sepetov, N., Sparkman, D.A. and Hodge, C.N. (2004) Streamlined systemfor purifying and quantifying a diverse library of compounds and the effect of compound concentration measurements on the accurate interpretation ofbiological assay results. Analytical Chemistry, 76, 7278-7287.
-
(2004)
Analytical Chemistry
, vol.76
, pp. 7278-7287
-
-
Popa-Burke, I.G.1
Issakova, O.2
Arroway, J.D.3
Bernasconi, P.4
Chen, M.5
Coudurier, L.6
Galasinski, S.7
Jadhav, A.P.8
Janzen, W.P.9
Lagasca, D.10
Liu, D.11
Lewis, R.S.12
Mohney, R.P.13
Sepetov, N.14
Sparkman, D.A.15
Hodge, C.N.16
-
16
-
-
33750000906
-
High throughput solubility measurement with automated polarized light microscopy analysis
-
Sugano, K., Kato, T., Suzuki, K., Keiko, K., Sujaku, T. and Mano, T. (2006) High throughput solubility measurement with automated polarized light microscopy analysis. Journal ofPharmaceutical Sciences, 95 (10), 2115-2122.
-
(2006)
Journal ofPharmaceutical Sciences
, vol.95
, Issue.10
, pp. 2115-2122
-
-
Sugano, K.1
Kato, T.2
Suzuki, K.3
Keiko, K.4
Sujaku, T.5
Mano, T.6
-
17
-
-
0034655372
-
A high-throughput screening method for the determination of aqueous drug solubility using laser nephelometry in micro-titer plates
-
Bevan, C. and Lloyd, R.S. (2000) A high-throughput screening method for the determination of aqueous drug solubility using laser nephelometry in micro-titer plates. Analytical Chemistry, 72, 1781-1787.
-
(2000)
Analytical Chemistry
, vol.72
, pp. 1781-1787
-
-
Bevan, C.1
Lloyd, R.S.2
-
18
-
-
7444226830
-
Automated robotic liquid handling/laser-based nephelometry system for high throughput measurement of kinetic aqueous solubility
-
Dehring, K.A., Workman, H.L., Miller, K. D., Mandagere, A. and Poole, S.K. (2004) Automated robotic liquid handling/laser-based nephelometry system for high throughput measurement of kinetic aqueous solubility. Journal of Pharmaceutical and Biomedical Analysis, 36, 447-456.
-
(2004)
Journal of Pharmaceutical and Biomedical Analysis
, vol.36
, pp. 447-456
-
-
Dehring, K.A.1
Workman, H.L.2
Miller, K.D.3
Mandagere, A.4
Poole, S.K.5
-
19
-
-
85017662235
-
A fully automated workstation for testing flow based kinetic solubility of compounds
-
Poster Presentation, BD Biosciences, Two Oak Park, Bedford, MA, USA
-
Lilley, M., Shanter, M., Ardiff, M., Ciolkosz, T., Kashdan, M., Aubin, C. and Goodwin, J. A fully automated workstation for testing flow based kinetic solubility of compounds. Poster Presentation, BD Biosciences, Two Oak Park, Bedford, MA, USA.
-
-
-
Lilley, M.1
Shanter, M.2
Ardiff, M.3
Ciolkosz, T.4
Kashdan, M.5
Aubin, C.6
Goodwin, J.7
-
20
-
-
0036828814
-
Evaluation of a method for high throughput solubility determination using a multi-wavelength UV plate reader
-
Chen, T., Shen, H. and Zhu, C. (2002) Evaluation of a method for high throughput solubility determination using a multi-wavelength UV plate reader. Combinatorial Chemistry & High Throughput Screening, 5, 575-581.
-
(2002)
Combinatorial Chemistry & High Throughput Screening
, vol.5
, pp. 575-581
-
-
Chen, T.1
Shen, H.2
Zhu, C.3
-
21
-
-
0003800267
-
Pharmacokinetic optimization in drug research
-
(eds B. Testa, H. van de Waterbeemd, G. Folkers and R. Guy), Verlag Helvetica Chimica Acta, Zurich
-
Avdeef, A. (2001) Pharmacokinetic optimization in drug research, in Biological, Physicochemical, and Computational Strategies (eds B. Testa, H. van de Waterbeemd, G. Folkers and R. Guy), Verlag Helvetica Chimica Acta, Zurich, pp. 305-326.
-
(2001)
Biological, Physicochemical, and Computational Strategies
, pp. 305-326
-
-
Avdeef, A.1
-
22
-
-
34548040152
-
High throughput solubility measurement in drug discovery and development
-
Alsenz, J. and Kansy, M. (2007) High throughput solubility measurement in drug discovery and development. Advanced Drug Delivery Reviews, 59, 546-567.
-
(2007)
Advanced Drug Delivery Reviews
, vol.59
, pp. 546-567
-
-
Alsenz, J.1
Kansy, M.2
-
23
-
-
44949141992
-
High throughput solubility determination with application to selection of compounds for fragment screening
-
Colclough, N., Hunter, A., Kenny, P.W., Kittlety, R.S., Lobedan, L., Tam, K.Y. and Timms, M.A. (2008) High throughput solubility determination with application to selection of compounds for fragment screening. Bioorganic & Medicinal Chemistry, 16, 6611-6616.
-
(2008)
Bioorganic & Medicinal Chemistry
, vol.16
, pp. 6611-6616
-
-
Colclough, N.1
Hunter, A.2
Kenny, P.W.3
Kittlety, R.S.4
Lobedan, L.5
Tam, K.Y.6
Timms, M.A.7
-
26
-
-
1142303337
-
What is the true solubility advantage for amorphous pharmaceuticals
-
Hancock, B. and Parks, M. (2000) What is the true solubility advantage for amorphous pharmaceuticals. Pharmaceutical Research, 17 (4), 397-404.
-
(2000)
Pharmaceutical Research
, vol.17
, Issue.4
, pp. 397-404
-
-
Hancock, B.1
Parks, M.2
-
27
-
-
33645079631
-
Evaluation of the chemiluminescent nitrogen detector for solubility determinations to support drug discovery
-
Bhattachar, S.N., Welsey, J.A. and Seadeek, S. (2006) Evaluation of the chemiluminescent nitrogen detector for solubility determinations to support drug discovery. Journal of Pharmaceutical and Biomedical Analysis, 41, 152-157.
-
(2006)
Journal of Pharmaceutical and Biomedical Analysis
, vol.41
, pp. 152-157
-
-
Bhattachar, S.N.1
Welsey, J.A.2
Seadeek, S.3
-
28
-
-
85017633574
-
High-throughput solubility
-
PhysChem Forum 3, June 2007
-
Hill, A. (2007) High-throughput solubility. PhysChem Forum 3, June 2007.
-
(2007)
-
-
Hill, A.1
-
29
-
-
85017657119
-
CAD detector validation and potential for physicochemical measurements
-
PhysChem Forum 3, June 2007
-
Reilly, J. (2007) CAD detector validation and potential for physicochemical measurements. PhysChem Forum 3, June 2007.
-
(2007)
-
-
Reilly, J.1
-
30
-
-
12244263506
-
Comparison ofa minaturized shake-flask solubility method with automated potentiometric acid/base titrations and calculated solubilities
-
Glomme, A., Marz, J. and Dressman, J.B. (2005) Comparison ofa minaturized shake-flask solubility method with automated potentiometric acid/base titrations and calculated solubilities. Journal of Pharmaceutical Sciences, 94 (1), 1-16.
-
(2005)
Journal of Pharmaceutical Sciences
, vol.94
, Issue.1
, pp. 1-16
-
-
Glomme, A.1
Marz, J.2
Dressman, J.B.3
-
31
-
-
85017655303
-
Exploring the solubility limit of CNS discovery candidates
-
CHI's Molecular Medicine TriConference, February 21-25, San Francisco, CA
-
Alelyunas, Y. (2006) Exploring the solubility limit of CNS discovery candidates. CHI's Molecular Medicine TriConference, February 21-25, San Francisco, CA.
-
(2006)
-
-
Alelyunas, Y.1
-
32
-
-
33947360663
-
Automated approach to couple solubility with final pH and crystallinity for pharmaceutical discovery compounds
-
Seadeek, C., Ando, H., Bhattachar, S.N., Heimbach, T., Sonnenberg, J.L. and Blackburn, A.C. (2007) Automated approach to couple solubility with final pH and crystallinity for pharmaceutical discovery compounds. Journal of Pharmaceutical and Biomedical Analysis, 43, 1660-1666.
-
(2007)
Journal of Pharmaceutical and Biomedical Analysis
, vol.43
, pp. 1660-1666
-
-
Seadeek, C.1
Ando, H.2
Bhattachar, S.N.3
Heimbach, T.4
Sonnenberg, J.L.5
Blackburn, A.C.6
-
33
-
-
34247574319
-
Miniaturized assay for solubility and residual solid screening (SORESOS) in early drug development
-
Wyttenbach, N., Alsenz, J. and Grassmann, O. (2007) Miniaturized assay for solubility and residual solid screening (SORESOS) in early drug development. Pharmaceutical Research, 24 (5), 888-898.
-
(2007)
Pharmaceutical Research
, vol.24
, Issue.5
, pp. 888-898
-
-
Wyttenbach, N.1
Alsenz, J.2
Grassmann, O.3
-
34
-
-
34247552300
-
Development ofa partially automated solubility screening (PASS) assay for early drug development
-
Alsenz, J., Meister, E. and Haenel, E. (2007) Development ofa partially automated solubility screening (PASS) assay for early drug development. Journal of Pharma-ceutical Sciences, 96 (7), 1748-1762.
-
(2007)
Journal of Pharma-ceutical Sciences
, vol.96
, Issue.7
, pp. 1748-1762
-
-
Alsenz, J.1
Meister, E.2
Haenel, E.3
-
35
-
-
30344440543
-
Solubility in water and DMSO: issues and potential solutions
-
Lipinski, C.A. (2004) Solubility in water and DMSO: issues and potential solutions. Pharmaceutical Profiling in Drug Discovery, 1, 93-125.
-
(2004)
Pharmaceutical Profiling in Drug Discovery
, vol.1
, pp. 93-125
-
-
Lipinski, C.A.1
-
36
-
-
84899706340
-
Solid state properties
-
(ed. M.E. Aulton), Churchill Livingstone, Edinburgh
-
Buckton, G. (2002) Solid state properties, in Pharmaceutics: The Science ofDosage Form Design (ed. M.E. Aulton), Churchill Livingstone, Edinburgh, pp. 141-151.
-
(2002)
Pharmaceutics: The Science ofDosage Form Design
, pp. 141-151
-
-
Buckton, G.1
-
37
-
-
1042264121
-
Impact of solid state properties on developability assessment of drug candidates
-
Huang, L.F. and Tong, W.Q. (2004) Impact of solid state properties on developability assessment of drug candidates. Advanced Drug Delivery Reviews, 56, 321-334.
-
(2004)
Advanced Drug Delivery Reviews
, vol.56
, pp. 321-334
-
-
Huang, L.F.1
Tong, W.Q.2
-
38
-
-
34548039925
-
Solubility of sparingly-soluble ionizable drugs
-
Avdeef, A. (2007) Solubility of sparingly-soluble ionizable drugs. Advanced Drug Delivery Reviews, 59, 568-590.
-
(2007)
Advanced Drug Delivery Reviews
, vol.59
, pp. 568-590
-
-
Avdeef, A.1
-
39
-
-
0034006672
-
pH-metric solubility. 2. Correlation between the acid-base titration and the saturation shake-flask solubility-pH methods
-
Avdeef, A., Berger, C.M. and Brownell, C. (2000) pH-metric solubility. 2. Correlation between the acid-base titration and the saturation shake-flask solubility-pH methods. Pharmaceutical Research, 17 (1), 85-89.
-
(2000)
Pharmaceutical Research
, vol.17
, Issue.1
, pp. 85-89
-
-
Avdeef, A.1
Berger, C.M.2
Brownell, C.3
-
40
-
-
13844320734
-
Chasing equilibrium: measuring the intrinsic solubilityofweakacids andbases
-
Stuart, M. and Box, K. (2005) Chasing equilibrium: measuring the intrinsic solubilityofweakacids andbases. Analytical Chemistry, 77, 983-990.
-
(2005)
Analytical Chemistry
, vol.77
, pp. 983-990
-
-
Stuart, M.1
Box, K.2
-
41
-
-
33847787350
-
Diclofenac solubility: independent determination of the intrinsic solubility of three crystal forms
-
Llinas, A., Burley, J.C., Box, K.J., Glen, R.C. and Goodman, J.M. (2007) Diclofenac solubility: independent determination of the intrinsic solubility of three crystal forms. Journal of Medicinal Chemistry, 50, 979-983.
-
(2007)
Journal of Medicinal Chemistry
, vol.50
, pp. 979-983
-
-
Llinas, A.1
Burley, J.C.2
Box, K.J.3
Glen, R.C.4
Goodman, J.M.5
-
42
-
-
33745053147
-
Equilibrium versus kinetic measurements of aqueous solubility, and the ability of compounds to supersaturate in solution: a validation study
-
Box, K.J., Volgyi, G., Baka, E., Stuart, M., Takacs-Novak, K. and Comer, J.E.A. (2006) Equilibrium versus kinetic measurements of aqueous solubility, and the ability of compounds to supersaturate in solution: a validation study. Journal of Pharmaceutical Sciences, 95 (6), 1298-1307.
-
(2006)
Journal of Pharmaceutical Sciences
, vol.95
, Issue.6
, pp. 1298-1307
-
-
Box, K.J.1
Volgyi, G.2
Baka, E.3
Stuart, M.4
Takacs-Novak, K.5
Comer, J.E.A.6
-
43
-
-
33947304448
-
A new method for the reproducible generation of polymorphs: two forms of sulindac with very different solubilities
-
Llinas, A., Box, K.J., Burley, J.C., Glen, R.C. and Goodman, J.M. (2007) A new method for the reproducible generation of polymorphs: two forms of sulindac with very different solubilities. Journal of Applied Crystallography, 40, 379-381.
-
(2007)
Journal of Applied Crystallography
, vol.40
, pp. 379-381
-
-
Llinas, A.1
Box, K.J.2
Burley, J.C.3
Glen, R.C.4
Goodman, J.M.5
-
44
-
-
0035526164
-
Search for predictive generic model of aqueous solubility using Bayesian neural nets
-
Bruneau, P. (2001) Search for predictive generic model of aqueous solubility using Bayesian neural nets. Journal of Chemical Information and Computer Sciences, 41, 1605-1616.
-
(2001)
Journal of Chemical Information and Computer Sciences
, vol.41
, pp. 1605-1616
-
-
Bruneau, P.1
-
45
-
-
33750976700
-
Matched molecular pairs as a guide in the optimization of pharmaceutical properties: a study of aqueous solubility, plasma protein binding and oral exposure
-
Leach, A.G., Jones, H.D., Cosgrove, D.A., Kenny, P.W., Ruston, L., Macfaul, P., Wood, J.M., Colclough, N. and Law, B. (2006) Matched molecular pairs as a guide in the optimization of pharmaceutical properties: a study of aqueous solubility, plasma protein binding and oral exposure. Journal ofMedicinal Chemistry, 49 (23), 6672-6682.
-
(2006)
Journal ofMedicinal Chemistry
, vol.49
, Issue.23
, pp. 6672-6682
-
-
Leach, A.G.1
Jones, H.D.2
Cosgrove, D.A.3
Kenny, P.W.4
Ruston, L.5
Macfaul, P.6
Wood, J.M.7
Colclough, N.8
Law, B.9
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