Estimation of the aqueous solubility I: application to organic nonelectrolytes.
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Summary
The revised GSE is validated on a set of 580 pharmaceutically, environmentally, and industrially relevant nonelectrolytes and provides a more accurate estimation of aqueous solubility.
- Type
- article
- Published
- 2001-02-01
- Cited by
- 331
- References
- 21
- Access
- Open access
- OpenAlex
- https://openalex.org/W2082291447
- Semantic Scholar
- https://api.semanticscholar.org/CorpusID:42235595
Keywords
Solubility, Aqueous solution, Chemistry, Estimation, Set (abstract data type)
References
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- Physical chemical properties of drugs
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- Illustrated handbook of physical-chemical properties and environmental fate for organic chemicals. Volume 5: pesticide chemicals.
- Estimation of the aqueous solubility of complex organic compounds
- Group contribution methods to estimate water solubility of organic chemicals
- Improved method for estimating water solubility from octanol/water partition coefficient
- QSPR Studies on Vapor Pressure, Aqueous Solubility, and the Prediction of Water-Air Partition Coefficients
- Group Contribution Methods for Predicting the Melting Points and Boiling Points of Aromatic Compounds
- Boiling Point and Melting Point Prediction for Aliphatic, Non-Hydrogen-Bonding Compounds
- Solubility and partitioning I: Solubility of nonelectrolytes in water.
- Prediction of Aqueous Solubility of Organic Compounds from Molecular Structure
- Determination of octanol-water partition coefficient for terpenoids using reversed-phase high-performance liquid chromatography.
- Vapour pressures, aqueous solubilities, Henry's law constants, partition coefficients between gas/water (Kgw), n-octanol/water (Kow) and gas/n-octanol (Kgo) of 106 polychlorinated diphenyl ethers (PCDE)
- The correlation and prediction of the solubility of compounds in water using an amended solvation energy relationship.
- Linear free-energy relationship between partition coefficients and the aqueous solubility of organic liquids
- The Solubilities of Aromatic Nitro Compounds in Pure Water.
- Chemical property estimation: theory and application
Cited by
- MICRONEEDLE-ASSISTED TRANSDERMAL DELIVERY OF NALTREXONE SPECIES: IN VITRO PERMEATION AND IN VIVO PHARMACOKINETIC STUDIES
- Biophysical characterization of the bindng of homologous anthraquinone amides to DNA
- Preformulation Studies on the Anticancer Drug Imexon
- Associative Neural Network
- Determination and Temperature Dependence of n-Octanol/Water Partition Coefficients for Seven Sulfonamides from (298.15 to 333.15) K
- Predicting passive intestinal drug absorption: An interesting relationship between fraction absorbed and melting point
- Preformulation of Topical Chemopreventive Agents and the Solubility Estimation of Hydrated Solutes
- Drug bioavailability : estimation of solubility, permeability, absorption and bioavailability
- Hot-melt Extrusion Through Syringes
- Predicting Melting Points of Organic Molecules: Applications to Aqueous Solubility Prediction Using the General Solubility Equation
- Estimation of Aqueous Solubility of Organic Compounds with QSPR Approach
- Review of the cosolvency models for predicting solubility of drugs in water-cosolvent mixtures.
- Effect of hydrophilic additives on the dissolution and pharmacokinetic properties of itraconazole-enteric polymer hot-melt extruded amorphous solid dispersions
- A Simple Modified Absorption Potential
- Advanced formulation and processing technologies in the oral delivery of poorly water-soluble drugs
- Solvation and dilution thermodynamics of benzocaine in some aqueous and organic solvents
- Effect of the structure, solid state and lipophilicity on the solubility of novel bicyclic derivatives
- On the mechanism of drug release from oil suspensions in vitro using local anesthetics as model drug compounds.
- Prediction of intrinsic solubility of generic drugs using MLR, ANN and SVM analyses.
- A quantum mechanical quantitative structure-property relationship study of the melting point of a variety of organosilicons.
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