-
1
-
-
0000103677
-
Sur les lois qui président au partage d'un corps entre deux dissolvants
-
Berthelot, M.; Jungfleisch, E. Sur les lois qui président au partage d'un corps entre deux dissolvants (Concerning the rules that determine the partitioning of a solute between two solubilizing liquids). Ann. Chim. Phys. (4th Ser.) 1872, 26, 396-407.
-
(1872)
Ann. Chim. Phys. (4th Ser.)
, vol.26
, pp. 396-407
-
-
Berthelot, M.1
Jungfleisch, E.2
-
2
-
-
0001172394
-
Verteilung eines stoffes Zwischen zwei losunsmitteln und zwischen losungmittel und dampfraum
-
Nernst, W. Verteilung eines stoffes Zwischen zwei losunsmitteln und zwischen losungmittel und dampfraum (The liquid-liquid and gas-liquid partitioning of a solute). Z. Phys. Chem. (Leipzig) 1891, 8, 110-139.
-
(1891)
Z. Phys. Chem. (Leipzig)
, vol.8
, pp. 110-139
-
-
Nernst, W.1
-
3
-
-
0016722069
-
Selection of a reference partitioning system for drug design work
-
Smith, R. N.; Hansch, C.; Ames, M. M. Selection of a reference partitioning system for drug design work. J. Pharm. Sci. 1975, 64, 599-606.
-
(1975)
J. Pharm. Sci.
, vol.64
, pp. 599-606
-
-
Smith, R.N.1
Hansch, C.2
Ames, M.M.3
-
4
-
-
0029582936
-
Epidermal permeability-penetrant structure relationships: I. An analysis of methods of predicting penetration of monofunctional solute from aqueous solutions
-
Roberts, M. S.; Pugh, W. J.; Hadgraft, J.; Watkinson, A. C. Epidermal permeability-penetrant structure relationships: I. An analysis of methods of predicting penetration of monofunctional solute from aqueous solutions. Int. J. Pharm. 1995, 126, 219-233.
-
(1995)
Int. J. Pharm.
, vol.126
, pp. 219-233
-
-
Roberts, M.S.1
Pugh, W.J.2
Hadgraft, J.3
Watkinson, A.C.4
-
5
-
-
0029950564
-
Epidermal permeability-penetrant strucrure relationships: 2. the effect of H-bonding groups in penetrants on their diffusion through stratum corneum
-
Roberts, M. S.; Pugh, W. J.; Hadgraft, J. Epidermal permeability-penetrant strucrure relationships: 2. The effect of H-bonding groups in penetrants on their diffusion through stratum corneum. Int. J. Pharm. 1996, 132, 23-32.
-
(1996)
Int. J. Pharm.
, vol.132
, pp. 23-32
-
-
Roberts, M.S.1
Pugh, W.J.2
Hadgraft, J.3
-
6
-
-
0029768028
-
Epidermal permeability-penetrant structure relationships: 3. the effect of hydrogen-bonding interactions and molecular size on diffusion across the stratum corneum
-
Pugh, W. J.; Roberts, M. S.; Hadgraft, J. Epidermal permeability-penetrant structure relationships: 3. The effect of hydrogen-bonding interactions and molecular size on diffusion across the stratum corneum. Int. J. Pharm. 1996, 138, 149-165.
-
(1996)
Int. J. Pharm.
, vol.138
, pp. 149-165
-
-
Pugh, W.J.1
Roberts, M.S.2
Hadgraft, J.3
-
7
-
-
0023902147
-
2 receptor histamine antagonists
-
2 receptor histamine antagonists. J. Med. Chem. 1988, 31, 656-671.
-
(1988)
J. Med. Chem.
, vol.31
, pp. 656-671
-
-
Young, R.C.1
Mitchell, R.C.2
Brown, T.H.3
Ganellin, C.R.4
Grifiiths, R.5
Jones, M.6
Rana, K.K.7
Saunders, D.8
Smith, I.R.9
Sore, N.E.10
Wilks, T.J.11
-
8
-
-
0025999171
-
The influence of peptide structure on transport across Caco-2 cells
-
Conradi, R. A.; Hilgers, A. R.; Ho, N. F. H.; Burton, P. S. The influence of peptide structure on transport across Caco-2 cells. Pharm. Res. 1991, 8, 1453-1460.
-
(1991)
Pharm. Res.
, vol.8
, pp. 1453-1460
-
-
Conradi, R.A.1
Hilgers, A.R.2
Ho, N.F.H.3
Burton, P.S.4
-
9
-
-
0026513211
-
The influence of peptide structure on transport across Caco-2 cells. II. Peptide bond modification which results in improved permeability
-
Conradi, R. A.; Hilgers, A. R.; Ho, N. F. H.; Burton, P. S. The influence of peptide structure on transport across Caco-2 cells. II. Peptide bond modification which results in improved permeability. Pharm. Res. 1992, 9, 435-439.
-
(1992)
Pharm. Res.
, vol.9
, pp. 435-439
-
-
Conradi, R.A.1
Hilgers, A.R.2
Ho, N.F.H.3
Burton, P.S.4
-
10
-
-
0026535563
-
-
Burton, P. S.; Conradi, R. A.; Hilgers, A. R.; Ho, N. F. H.; Maggiora, L. L. Controlled Release 1992, 19, 87-98.
-
(1992)
Controlled Release
, vol.19
, pp. 87-98
-
-
Burton, P.S.1
Conradi, R.A.2
Hilgers, A.R.3
Ho, N.F.H.4
Maggiora, L.L.5
-
11
-
-
21144467893
-
Hydrogen-bonding capacity and brain penetration
-
van de Waterbeemd, H.; Kansy, M. Hydrogen-bonding capacity and brain penetration. Chimia 1992, 4, 299-303.
-
(1992)
Chimia
, vol.4
, pp. 299-303
-
-
Van De Waterbeemd, H.1
Kansy, M.2
-
12
-
-
37049081761
-
Model solvent systems for QSAR. Part 2. Fragment values (t-values) for the "critical quartet"
-
Leahy, D. E.; Morris, J. J.; Taylor, P. J.; Wait, A. R. Model solvent systems for QSAR. Part 2. Fragment values (t-values) for the "critical quartet". J. Chem. Soc., Perkin Trans. 2 1992, 723-731.
-
(1992)
J. Chem. Soc., Perkin Trans. 2
, pp. 723-731
-
-
Leahy, D.E.1
Morris, J.J.2
Taylor, P.J.3
Wait, A.R.4
-
14
-
-
0032197149
-
Multivariate analysis of experimental and computational descriptors of molecular lipophilicity
-
Mannhold, R.; Cruciani, G.; Dross, K.; Rekker, R. Multivariate analysis of experimental and computational descriptors of molecular lipophilicity. J. Comput.-Aided Mol. Des. 1998, 12, 573-581.
-
(1998)
J. Comput.-Aided Mol. Des.
, vol.12
, pp. 573-581
-
-
Mannhold, R.1
Cruciani, G.2
Dross, K.3
Rekker, R.4
-
15
-
-
84958605951
-
Lipophilicity descriptors for structure - Property correlation studies: Overview and experimental and theoretical methods and a benchmark of log P calculations
-
Lipophilicity in drug action and taxicology; Pliska, V., Testa, B., van de Waterbeemd, H., Eds.; VCH Publishers: Weinheim, Germany
-
van de Waterbeemd, H.; Mannhold, R. Lipophilicity descriptors for structure - property correlation studies: Overview and experimental and theoretical methods and a benchmark of log P calculations. In Lipophilicity in drug action and taxicology; Pliska, V., Testa, B., van de Waterbeemd, H., Eds.; Methods and principles in medicinal chemistry; VCH Publishers: Weinheim, Germany, 1996; Vol. 4, pp 401-418.
-
(1996)
Methods and Principles in Medicinal Chemistry
, vol.4
, pp. 401-418
-
-
Van De Waterbeemd, H.1
Mannhold, R.2
-
17
-
-
0032450868
-
The lipophilic behaviour of organic compounds: 1. An updating of the hydrophobic fragmental constant approach
-
Mannhold, R.; Rekker, R. F.; Dross, K.; Bijloo, G.; de Vries, G. The lipophilic behaviour of organic compounds: 1. An updating of the hydrophobic fragmental constant approach. Quant. Struct.-Act. Relat. 1998, 17, 517-536.
-
(1998)
Quant. Struct.-Act. Relat.
, vol.17
, pp. 517-536
-
-
Mannhold, R.1
Rekker, R.F.2
Dross, K.3
Bijloo, G.4
De Vries, G.5
-
18
-
-
0031706070
-
Octanol - Water Partition: Searching for Predictive Models
-
Buchwald, P.; Bodor, N. Octanol - Water Partition: Searching for Predictive Models. Curr. Med. Chem. 1998, 5, 353-380.
-
(1998)
Curr. Med. Chem.
, vol.5
, pp. 353-380
-
-
Buchwald, P.1
Bodor, N.2
-
19
-
-
0022745431
-
Intrinsic molecular volume as a measure of the cavity term in linear solvation energy relationships: Octanol-water partition coefficients and aqueous solubilities
-
Leahy, D. E. Intrinsic molecular volume as a measure of the cavity term in linear solvation energy relationships: Octanol-water partition coefficients and aqueous solubilities. J Pharm. Sci. 1986, 75, 629-636.
-
(1986)
J Pharm. Sci.
, vol.75
, pp. 629-636
-
-
Leahy, D.E.1
-
20
-
-
33845469300
-
Taft, R. W. Solubility properties in polymers and biological media. 4. Correlation of octanol/ water partition coefficients with solvatochromic parameters
-
Kamlet, M. J.; Abraham, M. H.; Doherty, R. M.; Taft, R. W. Solubility properties in polymers and biological media. 4. Correlation of octanol/ water partition coefficients with solvatochromic parameters. J. Am. Chem. Soc. 1984, 106, 464-466.
-
(1984)
J. Am. Chem. Soc.
, vol.106
, pp. 464-466
-
-
Kamlet, M.J.1
Abraham, M.H.2
Doherty, R.M.3
-
21
-
-
0021070609
-
Relationship between molar refraction and n-octanol/water partition coefficient
-
(21 ) Yoshida, K.; Shigeoka, T.; Yamaguchi, F. Relationship between molar refraction and n-octanol/water partition coefficient. Ecotoxicol. Environ. Saf. 1983, 7, 558-565.
-
(1983)
Ecotoxicol. Environ. Saf.
, vol.7
, pp. 558-565
-
-
Yoshida, K.1
Shigeoka, T.2
Yamaguchi, F.3
-
22
-
-
0022075964
-
Relationships between octanol/water partition coefficient and aqueous solubility
-
Miller, M. M.; Wasik, S. P.; Huang, G. L.; Shiu, W. Y.; Mackay, D. Relationships between octanol/water partition coefficient and aqueous solubility. Environ. Sci. Technol. 1985, 19, 522-529.
-
(1985)
Environ. Sci. Technol.
, vol.19
, pp. 522-529
-
-
Miller, M.M.1
Wasik, S.P.2
Huang, G.L.3
Shiu, W.Y.4
Mackay, D.5
-
23
-
-
0025336485
-
Relationships between octanol/water partition coefficients and total molecular surface area and total molecular volume of hydrophobic organic chemicals
-
de Bruijn, J. D.; Hermens, J. Relationships between octanol/water partition coefficients and total molecular surface area and total molecular volume of hydrophobic organic chemicals. Quant. Struct.-Act. Relat. 1990, 9, 11-21.
-
(1990)
Quant. Struct.-Act. Relat.
, vol.9
, pp. 11-21
-
-
De Bruijn, J.D.1
Hermens, J.2
-
24
-
-
0023399173
-
Correlation of octanol/water partition coefficient and total molecular surface area for highly hydrophobic aromatic compounds
-
Doucette, W. J.; Andren, A. W. Correlation of octanol/water partition coefficient and total molecular surface area for highly hydrophobic aromatic compounds. Environ. Sci. Technol. 1987, 21, 821-824.
-
(1987)
Environ. Sci. Technol.
, vol.21
, pp. 821-824
-
-
Doucette, W.J.1
Andren, A.W.2
-
25
-
-
0024656378
-
A new method for the estimation of partition coefficient
-
Bodor, N.; Gabanyi, Z.; Wong, C. K. A new method for the estimation of partition coefficient. J. Am. Chem. Soc. 1989, 111, 3783-3786.
-
(1989)
J. Am. Chem. Soc.
, vol.111
, pp. 3783-3786
-
-
Bodor, N.1
Gabanyi, Z.2
Wong, C.K.3
-
26
-
-
0032441013
-
Calculation of octanol-water partition coefficients of organic solutes from their molecular volumes
-
Edward, J. T. Calculation of octanol-water partition coefficients of organic solutes from their molecular volumes. Can. J. Chem. 1998, 76, 1294-1303.
-
(1998)
Can. J. Chem.
, vol.76
, pp. 1294-1303
-
-
Edward, J.T.1
-
27
-
-
0023263358
-
The role of solvent-accessible surface area in determining partition coefficient
-
Dunn, W. J., III; Koehler, M. G.; Grigoras, S. The role of solvent-accessible surface area in determining partition coefficient. J. Med. Chem. 1987, 30, 1121-1126.
-
(1987)
J. Med. Chem.
, vol.30
, pp. 1121-1126
-
-
Dunn W.J. III1
Koehler, M.G.2
Grigoras, S.3
-
28
-
-
84988112502
-
The calculation of molar polarizabilities by the CNDO/2 method: Correlation with the hydrophobic parameter, log P
-
Lewis, D. F. V. The calculation of molar polarizabilities by the CNDO/2 method: Correlation with the hydrophobic parameter, log P. J. Comput. Chem. 1989, 10, 145-151.
-
(1989)
J. Comput. Chem.
, vol.10
, pp. 145-151
-
-
Lewis, D.F.V.1
-
29
-
-
84988115591
-
Simple method of computing the partition coefficient
-
Klopman, G.; Namboodiri, K.; Schochet, M. Simple method of computing the partition coefficient. J. Comput. Chem. 1985, 6, 28-38.
-
(1985)
J. Comput. Chem.
, vol.6
, pp. 28-38
-
-
Klopman, G.1
Namboodiri, K.2
Schochet, M.3
-
30
-
-
0025752801
-
Prediction of octanol/water partition coefficients using parameters derived from molecular structures
-
Sasaki, Y.; Kubodera, H.; Matuzaki, T.; Umeyama, H. J. Prediction of octanol/water partition coefficients using parameters derived from molecular structures. Pharmacobio-Dyn. 1991, 14, 207-214.
-
(1991)
Pharmacobio-Dyn.
, vol.14
, pp. 207-214
-
-
Sasaki, Y.1
Kubodera, H.2
Matuzaki, T.3
Umeyama, H.J.4
-
31
-
-
0043287413
-
Prediction of RP-HPLC log P from semiempirical molecular properties of diphenyl ether and phenopylate herbicides
-
Nandihalli, U. B.: Duke, M. V.; Duke, S. O. Prediction of RP-HPLC log P from semiempirical molecular properties of diphenyl ether and phenopylate herbicides. J. Agric. Food Chem. 1993, 41, 582-587.
-
(1993)
J. Agric. Food Chem.
, vol.41
, pp. 582-587
-
-
Nandihalli, U.B.1
Duke, M.V.2
Duke, S.O.3
-
32
-
-
0026499497
-
Comparison of the solubility of polycyclic aromatic hydrocarbons in nonassociated and associated solvents: The hydrophobic effect
-
Ruelle, P.; Buchmann, M.; Hô, N.-T.; Kesselring, U. W. Comparison of the solubility of polycyclic aromatic hydrocarbons in nonassociated and associated solvents: The hydrophobic effect. Int. J. Pharm. 1992, 87, 47-57.
-
(1992)
Int. J. Pharm.
, vol.87
, pp. 47-57
-
-
Ruelle, P.1
Buchmann, M.2
Hô, N.-T.3
Kesselring, U.W.4
-
33
-
-
0027465604
-
Application of the Mobile Order theory to the Prediction of Aqueous Solubility of Chlorinated Benzenes and Biphenyls
-
Ruelle, P.; Buchmann, M.; Hô, N.-T.; Kesselring, U. W. Application of the Mobile Order theory to the Prediction of Aqueous Solubility of Chlorinated Benzenes and Biphenyls, Environ. Sci. Technol. 1993, 27, 266-270.
-
(1993)
Environ. Sci. Technol.
, vol.27
, pp. 266-270
-
-
Ruelle, P.1
Buchmann, M.2
Hô, N.-T.3
Kesselring, U.W.4
-
34
-
-
0028233898
-
Hydrophobic effect at the origin of the low solubility of inert solid substances in hydrogen-bonded solvents
-
Ruelle, P.; Buchmann, M.; Kesselring, U. W. Hydrophobic effect at the origin of the low solubility of inert solid substances in hydrogen-bonded solvents. J. Pharm. Sci. 1994, 83, 396-403.
-
(1994)
J. Pharm. Sci.
, vol.83
, pp. 396-403
-
-
Ruelle, P.1
Buchmann, M.2
Kesselring, U.W.3
-
35
-
-
0031054880
-
Aqueous Solubility Prediction of Environmentally Important Chemicals from the Mobile Order Thermodynamics
-
Ruelle, P.; Kesselring, U. W. Aqueous Solubility Prediction of Environmentally Important Chemicals from the Mobile Order Thermodynamics. Chemosphere 1997, 34, 275-298.
-
(1997)
Chemosphere
, vol.34
, pp. 275-298
-
-
Ruelle, P.1
Kesselring, U.W.2
-
36
-
-
0001603927
-
A new expression for the combinatorial entropy of mixing in liquid mixtures
-
Huyskens, P. L.; Haulait-Pirson, M. C. A new expression for the combinatorial entropy of mixing in liquid mixtures. J. Mol. Liq. 1985, 31, 135-151.
-
(1985)
J. Mol. Liq.
, vol.31
, pp. 135-151
-
-
Huyskens, P.L.1
Haulait-Pirson, M.C.2
-
38
-
-
0042077128
-
Mobile and static molecular disorder in liquids
-
Huyskens, P. L. Mobile and static molecular disorder in liquids. J. Mol. Struct. 1992, 274, 223-246.
-
(1992)
J. Mol. Struct.
, vol.274
, pp. 223-246
-
-
Huyskens, P.L.1
-
39
-
-
0025891084
-
A new predictive equation for the solubility of drugs based on the thermodynamics of mobile disorder
-
Ruelle, P.; Rey-Mermet, C.; Buchmann, M.; Hô, N.-T.; Kesselring, U. W.; Huyskens, P. L. A new predictive equation for the solubility of drugs based on the thermodynamics of mobile disorder. Pharm. Res. 1991, 8, 840-850.
-
(1991)
Pharm. Res.
, vol.8
, pp. 840-850
-
-
Ruelle, P.1
Rey-Mermet, C.2
Buchmann, M.3
Hô, N.-T.4
Kesselring, U.W.5
Huyskens, P.L.6
-
40
-
-
0030734719
-
The mobile order solubility equation applied to polyfunctional molecules: The non-hydroxysteroids in aqueous and nonaqueous solvents
-
Ruelle, P.; Fariña-Cuendet, A.; Kesselring, U. W. The mobile order solubility equation applied to polyfunctional molecules: The non-hydroxysteroids in aqueous and nonaqueous solvents. Int. J. Pharm. 1997, 157, 219-232.
-
(1997)
Int. J. Pharm.
, vol.157
, pp. 219-232
-
-
Ruelle, P.1
Fariña-Cuendet, A.2
Kesselring, U.W.3
-
41
-
-
0031828087
-
The hydrophobic effect. 2. Relative importance of the hydrophobic effect on the solubility of hydrophobes and pharmaceuticals in H-bonded solvents
-
Ruelle, P.; Kesselring, U. W. The hydrophobic effect. 2. Relative importance of the hydrophobic effect on the solubility of hydrophobes and pharmaceuticals in H-bonded solvents. J. Pharm. Sci. 1998, 87, 998-1014.
-
(1998)
J. Pharm. Sci.
, vol.87
, pp. 998-1014
-
-
Ruelle, P.1
Kesselring, U.W.2
-
42
-
-
0031828748
-
The hydrophobic effect. I. A consequence of the mobile order in H-bonded liquids
-
Ruelle, P.; Kesselring, U. W. The hydrophobic effect. I. A consequence of the mobile order in H-bonded liquids. J. Pharm. Sci. 1998, 87, 987-997.
-
(1998)
J. Pharm. Sci.
, vol.87
, pp. 987-997
-
-
Ruelle, P.1
Kesselring, U.W.2
-
43
-
-
0033452663
-
Towards a comprehensive nonergodic treatment of H-bonds and hydrophobocity in real solutions: The mobile order and disorder theory
-
Ruelle, P. Towards a comprehensive nonergodic treatment of H-bonds and hydrophobocity in real solutions: The mobile order and disorder theory. Perfect. Drug Discovery Des. 1999, 17 (1), 61-96.
-
(1999)
Perfect. Drug Discovery Des.
, vol.17
, Issue.1
, pp. 61-96
-
-
Ruelle, P.1
-
45
-
-
0031058468
-
The hydrophobic propensity of water toward amphiprotic solutes: Prediction and molecular origin of the aqueous solubility of aliphatic alcohols
-
Ruelle, P.; Kesselring, U. W. The hydrophobic propensity of water toward amphiprotic solutes: Prediction and molecular origin of the aqueous solubility of aliphatic alcohols. J. Pharm. Sci. 1997, 86, 179-186.
-
(1997)
J. Pharm. Sci.
, vol.86
, pp. 179-186
-
-
Ruelle, P.1
Kesselring, U.W.2
-
46
-
-
0032064162
-
Solubility prediction of n-fatty alcohols and sterols in complexing and noncomplexing solvents according to the mobile order theory
-
Ruelle, P.; Kesselring, U. W. Solubility prediction of n-fatty alcohols and sterols in complexing and noncomplexing solvents according to the mobile order theory. Can. J. Chem. 1998, 76, 553-565.
-
(1998)
Can. J. Chem.
, vol.76
, pp. 553-565
-
-
Ruelle, P.1
Kesselring, U.W.2
-
47
-
-
0021341795
-
Expanded solubility parameter approach. I. Naphthalene and benzoic acid in individual solvents
-
Beerbower, A.; Wu, P. L.; Martin, A. Expanded solubility parameter approach. I. Naphthalene and benzoic acid in individual solvents. J. Pharm. Sci. 1984, 73, 179-188.
-
(1984)
J. Pharm. Sci.
, vol.73
, pp. 179-188
-
-
Beerbower, A.1
Wu, P.L.2
Martin, A.3
-
48
-
-
0026934145
-
Enhancement of the solubilities of poplycyclic aromatic hydrocarbons by weak hydrogen bonds with water
-
Ruelle, P.; Buchmann, M.; Hô, N.-T.; Kesselring, U. W. Enhancement of the solubilities of poplycyclic aromatic hydrocarbons by weak hydrogen bonds with water. J. Comput.-Aided Mol. Des. 1992, 6, 431 -448.
-
(1992)
J. Comput.-Aided Mol. Des.
, vol.6
, pp. 431-448
-
-
Ruelle, P.1
Buchmann, M.2
Hô, N.-T.3
Kesselring, U.W.4
-
49
-
-
0017126788
-
Dependence of hydrophobicity of apolar molecules on their molecular volumes
-
Leo, A.; Hansch, C.; Jow, P. Y. C. Dependence of hydrophobicity of apolar molecules on their molecular volumes. J. Med. Chem. 1976, 19, 611-615.
-
(1976)
J. Med. Chem.
, vol.19
, pp. 611-615
-
-
Leo, A.1
Hansch, C.2
Jow, P.Y.C.3
-
50
-
-
0024262698
-
Empirical relationships between the 1-octanol/water partition coefficient and nine physicochemical properties
-
Mailhot, H.; Peters, R. H. Empirical relationships between the 1-octanol/water partition coefficient and nine physicochemical properties. Environ. Sci. Technol. 1988, 22, 1479-1488.
-
(1988)
Environ. Sci. Technol.
, vol.22
, pp. 1479-1488
-
-
Mailhot, H.1
Peters, R.H.2
-
51
-
-
0024035138
-
Physical-chemical properties of chlorinated dibenzo-p-dioxins
-
Shiu, W. Y.; Doucette, W. J.; Gobas, F. A. P. C.; Andren, A.; Mackay, D. Physical-chemical properties of chlorinated dibenzo-p-dioxins. Environ. Sci. Technol. 1988, 22, 651-658.
-
(1988)
Environ. Sci. Technol.
, vol.22
, pp. 651-658
-
-
Shiu, W.Y.1
Doucette, W.J.2
Gobas, F.A.P.C.3
Andren, A.4
Mackay, D.5
-
52
-
-
0026590304
-
An extended version of a novel method for the estimation of partition coefficients
-
Bodor, N.; Huang, M.-J. An extended version of a novel method for the estimation of partition coefficients. J. Pharm. Sci. 1992, 81, 272 -281.
-
(1992)
J. Pharm. Sci.
, vol.81
, pp. 272-281
-
-
Bodor, N.1
Huang, M.-J.2
-
53
-
-
0027982335
-
Hydrogen bonding. 32. An analysis of water-octanol and water-alkane partitioning and the Alog P parameter of Seiler
-
Abraham, M. H.; Chadha, H. S.; Whiting, G. S.; Mitchell, R. C. Hydrogen bonding. 32. An analysis of water-octanol and water-alkane partitioning and the Alog P parameter of Seiler. J. Pharm. Sci. 1994, 83, 1085-1100.
-
(1994)
J. Pharm. Sci.
, vol.83
, pp. 1085-1100
-
-
Abraham, M.H.1
Chadha, H.S.2
Whiting, G.S.3
Mitchell, R.C.4
-
54
-
-
0001590002
-
Molecular size based approach to estimate partition properties for organic solutes
-
Bodor, N.; Buchwald, P. Molecular size based approach to estimate partition properties for organic solutes. J. Phys. Chem. B 1997, 101, 3404-3412.
-
(1997)
J. Phys. Chem. B
, vol.101
, pp. 3404-3412
-
-
Bodor, N.1
Buchwald, P.2
-
55
-
-
0031853128
-
The hydrophobic effect. 3. A key ingredient in predicting n-octanol-water partition coefficients
-
Ruelle, P.; Kesselring, U. W. The hydrophobic effect. 3. A key ingredient in predicting n-octanol-water partition coefficients. J. Pharm. Sci. 1998, 87, 1015-1024.
-
(1998)
J. Pharm. Sci.
, vol.87
, pp. 1015-1024
-
-
Ruelle, P.1
Kesselring, U.W.2
-
56
-
-
0000448580
-
Understanding the volume-solubility dependence: The mobile ordre and disorder view
-
Ruelle, P. Understanding the volume-solubility dependence: The mobile ordre and disorder view. J. Phys. Org. Chem. 1999, 12, 769-786.
-
(1999)
J. Phys. Org. Chem.
, vol.12
, pp. 769-786
-
-
Ruelle, P.1
-
58
-
-
0028426082
-
Estimation of the molar free energy of melting of crystals from solubility data according to the theory of the mobile disorder
-
Huyskens, P. L.; Seghers, K.; Morissen, H. Estimation of the molar free energy of melting of crystals from solubility data according to the theory of the mobile disorder. Fluid Phase Equilibr. 1994, 96, 1-18.
-
(1994)
Fluid Phase Equilibr.
, vol.96
, pp. 1-18
-
-
Huyskens, P.L.1
Seghers, K.2
Morissen, H.3
-
59
-
-
0028414165
-
Partial molar volumes of some drugs in water and ethanol at 35 °C
-
Iqbal, M.; Jamal, M. A.; Ahmed, M.; Ahmed, B. Partial molar volumes of some drugs in water and ethanol at 35 °C. Can. J. Chem. 1994, 72, 1076-1079.
-
(1994)
Can. J. Chem.
, vol.72
, pp. 1076-1079
-
-
Iqbal, M.1
Jamal, M.A.2
Ahmed, M.3
Ahmed, B.4
-
60
-
-
37049111928
-
Partial molar volumes of organic compounds in water. Part 1. Ethers, ketones, esters and alcohols
-
Edward, J. T.; Farrell, P. G.; Shahidi, F. Partial molar volumes of organic compounds in water. Part 1. Ethers, ketones, esters and alcohols. J. Chem. Soc., Faraday Trans. 1 1977, 73, 705-714.
-
(1977)
J. Chem. Soc., Faraday Trans. 1
, vol.73
, pp. 705-714
-
-
Edward, J.T.1
Farrell, P.G.2
Shahidi, F.3
-
61
-
-
0000790051
-
Partial molar volumes of organic compounds in water. Part 2. Amines and amides
-
Shahidi, F.; Farrell, P. G.; Edward, J. T. Partial molar volumes of organic compounds in water. Part 2. Amines and amides. J. Chem. Soc., Faraday Trans. 1 1977, 73, 715-721.
-
(1977)
J. Chem. Soc., Faraday Trans. 1
, vol.73
, pp. 715-721
-
-
Shahidi, F.1
Farrell, P.G.2
Edward, J.T.3
-
62
-
-
0034026436
-
Hydrophobic and solvation effects on the solubility of hydroxysteroids in various solvents: Quantitative and qualitative assessment by application of the mobile order and disorder theory
-
Ruelle, P.; Fariña-Cuendet, A.; Kesselring, U. W. Hydrophobic and solvation effects on the solubility of hydroxysteroids in various solvents: Quantitative and qualitative assessment by application of the mobile order and disorder theory. Perspect. Drug Discovery Des. 2000, 18(1), 61-112.
-
(2000)
Perspect. Drug Discovery Des.
, vol.18
, Issue.1
, pp. 61-112
-
-
Ruelle, P.1
Fariña-Cuendet, A.2
Kesselring, U.W.3
-
63
-
-
0028327191
-
Solubility Predictions for solid nitriles and tertiary amides based on the mobile order theory
-
Ruelle, P.; Kesselring, U. W. Solubility Predictions for solid nitriles and tertiary amides based on the mobile order theory. Pharm. Res. 1994, 11, 201-205.
-
(1994)
Pharm. Res.
, vol.11
, pp. 201-205
-
-
Ruelle, P.1
Kesselring, U.W.2
-
64
-
-
0028197071
-
Prediction of carbazole solubility and its dependence upon the solvent nature
-
Ruelle, P.; Sarraf, E.; Kesselring, U. W. Prediction of carbazole solubility and its dependence upon the solvent nature. Int. J. Pharm. 1994, 104, 125-133.
-
(1994)
Int. J. Pharm.
, vol.104
, pp. 125-133
-
-
Ruelle, P.1
Sarraf, E.2
Kesselring, U.W.3
-
65
-
-
33748720639
-
Prediction of the aqueous solubility of proton-acceptor oxygen-containing compounds by the mobile order solubility model
-
Ruelle, P.; Kesselring, U. W. Prediction of the aqueous solubility of proton-acceptor oxygen-containing compounds by the mobile order solubility model. J. Chem. Soc., Faraday Trans. 1997, 93, 2049-2052.
-
(1997)
J. Chem. Soc., Faraday Trans.
, vol.93
, pp. 2049-2052
-
-
Ruelle, P.1
Kesselring, U.W.2
-
66
-
-
0033971341
-
The n-octanol and the n-hexane/water partition coefficient of environmentally relevant chemicals predicted from the mobile order and disorder (MOD) thermodynamics
-
Ruelle, P. The n-octanol and the n-hexane/water partition coefficient of environmentally relevant chemicals predicted from the mobile order and disorder (MOD) thermodynamics. Chemosphere 2000, 40, 457-512.
-
(2000)
Chemosphere
, vol.40
, pp. 457-512
-
-
Ruelle, P.1
-
67
-
-
0027183053
-
The effect of proton-acceptor sites of the solute on its solubility in proton-donor solvents
-
Ruelle, P.; Sarraf, E.; Van den Berge, L.; Buchmann, M.; U. W. Kesselring, U.W. The effect of proton-acceptor sites of the solute on its solubility in proton-donor solvents. Pharm. Acta Helv. 1993, 68, 49-60.
-
(1993)
Pharm. Acta Helv.
, vol.68
, pp. 49-60
-
-
Ruelle, P.1
Sarraf, E.2
Van Den Berge, L.3
Buchmann, M.4
Kesselring, U.W.5
-
69
-
-
6844220092
-
-
Dunn, W. J., III, Block, J. H., Pearlam, R. S., Eds.; Pergamon Press: New York
-
Dunn, W. J., III; Grigoras, S.; Johansson, E. In Partition Coefficient: Determination and Estimation; Dunn, W. J., III, Block, J. H., Pearlam, R. S., Eds.; Pergamon Press: New York, 1986; pp 21-35.
-
(1986)
Partition Coefficient: Determination and Estimation
, pp. 21-35
-
-
Dunn W.J. III1
Grigoras, S.2
Johansson, E.3
-
70
-
-
0000707503
-
Solvatochromic analysis of di-n-butyl ether/water partition coefficient as compared to other solvent systems
-
Pagliara, A.; Caron, G.; Lisa, G.; Fan, W.; Gaillard, P.; Carrupt, P. A.; Testa, B.; Abraham, M. H. Solvatochromic analysis of di-n-butyl ether/water partition coefficient as compared to other solvent systems. J. Chem. Soc., Perkin Trans. 2 1997, 2639-2643.
-
(1997)
J. Chem. Soc., Perkin Trans. 2
, pp. 2639-2643
-
-
Pagliara, A.1
Caron, G.2
Lisa, G.3
Fan, W.4
Gaillard, P.5
Carrupt, P.A.6
Testa, B.7
Abraham, M.H.8
-
71
-
-
0032766161
-
Correlation and estimation of gas-chloroform and water-chloroform partition coefficients by a linear free energy relationship method
-
Abraham, M. H.; Platts, J. A.; Mersey, A.; Leo, A. J.; Taft, R. W. Correlation and estimation of gas-chloroform and water-chloroform partition coefficients by a linear free energy relationship method. J. Pharm. Sci. 1999, 88, 670-679.
-
(1999)
J. Pharm. Sci.
, vol.88
, pp. 670-679
-
-
Abraham, M.H.1
Platts, J.A.2
Mersey, A.3
Leo, A.J.4
Taft, R.W.5
-
74
-
-
0003758672
-
-
Dunn, W. J., III, Block, J. H., Pearlam, R. S., Eds.; Pergamon Press: New York
-
Chiou, C. T.; Block, J. H. In Partition Coefficient: Determination and Estimation; Dunn, W. J., III, Block, J. H., Pearlam, R. S., Eds.; Pergamon Press: New York, 1986; pp 37-60.
-
(1986)
Partition Coefficient: Determination and Estimation
, pp. 37-60
-
-
Chiou, C.T.1
Block, J.H.2
-
75
-
-
0025731738
-
Partitioning of solutes in different solvent systems: The contribution of hydrogen-bonding capacity and polarity
-
El Tayar, N.; Tsai, R.-S.; Testa, B.; Carrupt, P. A.; Leo, A. Partitioning of solutes in different solvent systems: The contribution of hydrogen-bonding capacity and polarity. J. Pharm. Sci. 1991, 80, 590-598.
-
(1991)
J. Pharm. Sci.
, vol.80
, pp. 590-598
-
-
El Tayar, N.1
Tsai, R.-S.2
Testa, B.3
Carrupt, P.A.4
Leo, A.5
-
76
-
-
33748658297
-
Intermolecular forces expressed in 1,2-dichloroethane-water partition coefficients. A solvatochromic analysis
-
Steyaert, G.; Lisa, G.; Gaillard, P.; Boss, G.; Reymomd, F.; Girault, H. H.; Carrupt, P. A.; Testa, B. Intermolecular forces expressed in 1,2-dichloroethane-water partition coefficients. A solvatochromic analysis. J. Chem. Soc., Faraday Trans. 1997, 93, 401-406.
-
(1997)
J. Chem. Soc., Faraday Trans.
, vol.93
, pp. 401-406
-
-
Steyaert, G.1
Lisa, G.2
Gaillard, P.3
Boss, G.4
Reymomd, F.5
Girault, H.H.6
Carrupt, P.A.7
Testa, B.8
-
77
-
-
0032101699
-
New approach for estimating alcohol partition coefficients between nonaqueous phase liquids and water
-
Dwarakanath, V.; Pope, G. A. New approach for estimating alcohol partition coefficients between nonaqueous phase liquids and water. Environ. Sci. Technol. 1998, 32, 1662-1666.
-
(1998)
Environ. Sci. Technol.
, vol.32
, pp. 1662-1666
-
-
Dwarakanath, V.1
Pope, G.A.2
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