198 related articles for article (PubMed ID: 19582218)
1. QSPR studies on aqueous solubilities of drug-like compounds.
Duchowicz PR; Castro EA
Int J Mol Sci; 2009 Jun; 10(6):2558-2577. PubMed ID: 19582218
[TBL] [Abstract][Full Text] [Related]
2. New QSPR study for the prediction of aqueous solubility of drug-like compounds.
Duchowicz PR; Talevi A; Bruno-Blanch LE; Castro EA
Bioorg Med Chem; 2008 Sep; 16(17):7944-55. PubMed ID: 18701302
[TBL] [Abstract][Full Text] [Related]
3. Application of descriptors based on Lipinski's rules in the QSPR study of aqueous solubilities.
Duchowicz PR; Talevi A; Bellera C; Bruno-Blanch LE; Castro EA
Bioorg Med Chem; 2007 Jun; 15(11):3711-9. PubMed ID: 17418580
[TBL] [Abstract][Full Text] [Related]
4. Aqueous Drug Solubility: What Do We Measure, Calculate and QSPR Predict?
Raevsky OA; Grigorev VY; Polianczyk DE; Raevskaja OE; Dearden JC
Mini Rev Med Chem; 2019; 19(5):362-372. PubMed ID: 30058484
[TBL] [Abstract][Full Text] [Related]
5. A quantitative structure-property relationship for predicting drug solubility in PEG 400/water cosolvent systems.
Rytting E; Lentz KA; Chen XQ; Qian F; Venkatesh S
Pharm Res; 2004 Feb; 21(2):237-44. PubMed ID: 15032304
[TBL] [Abstract][Full Text] [Related]
6. Prediction of drug intestinal absorption by new linear and non-linear QSPR.
Talevi A; Goodarzi M; Ortiz EV; Duchowicz PR; Bellera CL; Pesce G; Castro EA; Bruno-Blanch LE
Eur J Med Chem; 2011 Jan; 46(1):218-28. PubMed ID: 21112128
[TBL] [Abstract][Full Text] [Related]
7. New predictors for several ADME/Tox properties: aqueous solubility, human oral absorption, and Ames genotoxicity using topological descriptors.
Votano JR; Parham M; Hall LH; Kier LB
Mol Divers; 2004; 8(4):379-91. PubMed ID: 15612642
[TBL] [Abstract][Full Text] [Related]
8. Predicting aqueous solubility from structure.
Delaney JS
Drug Discov Today; 2005 Feb; 10(4):289-95. PubMed ID: 15708748
[TBL] [Abstract][Full Text] [Related]
9. Improving ADMET Prediction Accuracy for Candidate Drugs: Factors to Consider in QSPR Modeling Approaches.
Chen M; Yang J; Tang C; Lu X; Wei Z; Liu Y; Yu P; Li H
Curr Top Med Chem; 2024; 24(3):222-242. PubMed ID: 38083894
[TBL] [Abstract][Full Text] [Related]
10. Rank-based ant system method for non-linear QSPR analysis: QSPR studies of the solubility parameter.
Bagheri M; Golbraikh A
SAR QSAR Environ Res; 2012 Jan; 23(1-2):59-86. PubMed ID: 22040297
[TBL] [Abstract][Full Text] [Related]
11. Recent advances on aqueous solubility prediction.
Wang J; Hou T
Comb Chem High Throughput Screen; 2011 Jun; 14(5):328-38. PubMed ID: 21470182
[TBL] [Abstract][Full Text] [Related]
12. Calculating the Solubilities of Drugs and Drug-Like Compounds in Octanol.
Alantary D; Yalkowsky S
J Pharm Sci; 2016 Sep; 105(9):2770-2773. PubMed ID: 27012225
[TBL] [Abstract][Full Text] [Related]
13. Prediction of aqueous solubility of a diverse set of compounds using quantitative structure-property relationships.
Cheng A; Merz KM
J Med Chem; 2003 Aug; 46(17):3572-80. PubMed ID: 12904062
[TBL] [Abstract][Full Text] [Related]
14. General theory for multiple input-output perturbations in complex molecular systems. 1. Linear QSPR electronegativity models in physical, organic, and medicinal chemistry.
González-Díaz H; Arrasate S; Gómez-SanJuan A; Sotomayor N; Lete E; Besada-Porto L; Ruso JM
Curr Top Med Chem; 2013; 13(14):1713-41. PubMed ID: 23889050
[TBL] [Abstract][Full Text] [Related]
15. QSPR prediction of aqueous solubility of drug-like organic compounds.
Ghasemi J; Saaidpour S
Chem Pharm Bull (Tokyo); 2007 Apr; 55(4):669-74. PubMed ID: 17409570
[TBL] [Abstract][Full Text] [Related]
16. Scores of extended connectivity fingerprint as descriptors in QSPR study of melting point and aqueous solubility.
Zhou D; Alelyunas Y; Liu R
J Chem Inf Model; 2008 May; 48(5):981-7. PubMed ID: 18465850
[TBL] [Abstract][Full Text] [Related]
17. A drug release study from hydroxypropylmethylcellulose (HPMC) matrices using QSPR modeling.
Ghafourian T; Safari A; Adibkia K; Parviz F; Nokhodchi A
J Pharm Sci; 2007 Dec; 96(12):3334-51. PubMed ID: 17626286
[TBL] [Abstract][Full Text] [Related]
18. ADME evaluation in drug discovery. 3. Modeling blood-brain barrier partitioning using simple molecular descriptors.
Hou TJ; Xu XJ
J Chem Inf Comput Sci; 2003; 43(6):2137-52. PubMed ID: 14632466
[TBL] [Abstract][Full Text] [Related]
19. New prediction methods for solubility parameters based on molecular sigma profiles using pharmaceutical materials.
Niederquell A; Wyttenbach N; Kuentz M
Int J Pharm; 2018 Jul; 546(1-2):137-144. PubMed ID: 29772285
[TBL] [Abstract][Full Text] [Related]
20. Development and validation of k-nearest-neighbor QSPR models of metabolic stability of drug candidates.
Shen M; Xiao Y; Golbraikh A; Gombar VK; Tropsha A
J Med Chem; 2003 Jul; 46(14):3013-20. PubMed ID: 12825940
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
