Solid‐State Perturbation for Solubility Improvement: A Proof of Concept | Zendy

Briggner LarsErik | Zendy; Hendrickx Ramon | Zendy; Kloo Lars | Zendy; Rosdahl Jan | Zendy; Svensson Per H. | Zendy

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Solid‐State Perturbation for Solubility Improvement: A Proof of Concept

Author(s) -

Briggner LarsErik,

Hendrickx Ramon,

Kloo Lars,

Rosdahl Jan,

Svensson Per H.

Publication year - 2011

Publication title -

chemmedchem

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.817

H-Index - 100

eISSN - 1860-7187

pISSN - 1860-7179

DOI - 10.1002/cmdc.201000405

Subject(s) - solubility , perturbation (astronomy) , computer science , solid state , molecule , chemistry , combinatorial chemistry , information retrieval , physics , organic chemistry , quantum mechanics

Simple and rational: The intrinsic solubility of a compound can be systematically improved by perturbing key interactions in its crystal structure. By carefully choosing the perturbation, the end result will be a molecule similar to the original one, but with significantly higher solubility. This methodology is demonstrated on a subset of benzodiazepines, resulting in significant improvement of their solubility.

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