Applications of chromatography derived lipophilicity, polarity, and 3D concepts such as conformational states, exposed polarity and intramolecular hydrogen bonds (IMHB), are discussed along with recently developed methods for incorporating these concepts into drug design strategies. In addition, the drug design process is described with examples and practices used at Pfizer, as well as experimental and computed parameters used for parallel optimization of properties leading to drug candidate nominations
Immobilized Artificial Membrane (IAM) chromatography constitutes a valuable tool for medicinal chemi...
In my thesis research, I suggest a heuristic molecular lipophilicity potential (HMLP), a structure-b...
Background & Introduction: Pyrrolobenzodiazepine (PBD) dimers are highly potent DNA cross-linking ag...
Applications of chromatography derived lipophilicity, polarity, and 3D concepts such as conformation...
During the early phase of drug discovery, it is becoming increasingly important to acquire the full ...
The drug discovery process can be accelerated by chromatographic profiling of the analogs to model i...
Block Relevance (BR) analysis is a tool to interpret QSPR/PLS models which can provide the informati...
The drug discovery process usually involves the discovery of a potent new chemical entity which has ...
IMPORTANCE OF THE FIELD: The role of lipophilicity in determining the overall quality of candidate d...
Phospholipophilicity, i.e. the affinity of a drug for phospholipids, is one of the key features modu...
Fraction Lipophicity Index (FLI) has been developed as a composite drug-like metric combining logP a...
A conformational analysis of all oral bRo5 drugs using a QM-based workflow and experimental structur...
The measurement of physicochemical properties at an early phase of drug discovery and development is...
Modern drug design and discovery not only focus on the pharmacological activity of a compound, but a...
As part of our endeavor to enhance survival of natural product derived drug candidates and to guide ...
Immobilized Artificial Membrane (IAM) chromatography constitutes a valuable tool for medicinal chemi...
In my thesis research, I suggest a heuristic molecular lipophilicity potential (HMLP), a structure-b...
Background & Introduction: Pyrrolobenzodiazepine (PBD) dimers are highly potent DNA cross-linking ag...
Applications of chromatography derived lipophilicity, polarity, and 3D concepts such as conformation...
During the early phase of drug discovery, it is becoming increasingly important to acquire the full ...
The drug discovery process can be accelerated by chromatographic profiling of the analogs to model i...
Block Relevance (BR) analysis is a tool to interpret QSPR/PLS models which can provide the informati...
The drug discovery process usually involves the discovery of a potent new chemical entity which has ...
IMPORTANCE OF THE FIELD: The role of lipophilicity in determining the overall quality of candidate d...
Phospholipophilicity, i.e. the affinity of a drug for phospholipids, is one of the key features modu...
Fraction Lipophicity Index (FLI) has been developed as a composite drug-like metric combining logP a...
A conformational analysis of all oral bRo5 drugs using a QM-based workflow and experimental structur...
The measurement of physicochemical properties at an early phase of drug discovery and development is...
Modern drug design and discovery not only focus on the pharmacological activity of a compound, but a...
As part of our endeavor to enhance survival of natural product derived drug candidates and to guide ...
Immobilized Artificial Membrane (IAM) chromatography constitutes a valuable tool for medicinal chemi...
In my thesis research, I suggest a heuristic molecular lipophilicity potential (HMLP), a structure-b...
Background & Introduction: Pyrrolobenzodiazepine (PBD) dimers are highly potent DNA cross-linking ag...