A consistent dataset of kinetic solubilities for early-phase drug discovery

ChemMedChem

Volumn 4, Issue 9, 2009, Pages 1529-1536

  Kramer, Christian ^a,b   Heinisch, Tilmann ^c   Fligge, Thilo ^b   Beck, Bernd ^b   Clark, Timothy ^a  

^a UNIVERSITY OF ERLANGEN NUREMBERG   (Germany)

^b BOEHRINGER INGELHEIM PHARMA GMBH AND CO KG   (Germany)

^c UNIVERSITY OF BASEL   (Switzerland)

Author keywords

Chemoinformatics; Datasets; Drug discovery; Nephelometry; Solubility

Indexed keywords

ALGORITHM; AQUEOUS SOLUTION; ARTICLE; CLASSIFICATION; HIGH THROUGHPUT SCREENING; HYDROGEN BOND; KINETICS; LIPOPHILICITY; MOLECULAR WEIGHT; NEPHELOMETRY; PRIORITY JOURNAL; RANDOM FOREST; SOLUBILITY; STRUCTURE ACTIVITY RELATION; THERMODYNAMICS;

ALGORITHMS; DRUG DISCOVERY; NEPHELOMETRY AND TURBIDIMETRY; ORGANIC CHEMICALS; SOLUBILITY;

EID: 69749091529     PISSN: 18607179     EISSN: 18607187     Source Type: Journal    
DOI: 10.1002/cmdc.200900205     Document Type: Article

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