Fast calculation of molecular polar surface area as a sum of fragment-based contributions and its application to the prediction of drug transport properties

Journal of Medicinal Chemistry

Volumn 43, Issue 20, 2000, Pages 3714-3717

  Ertl, P ^a   Rohde, B ^a   Selzer, P ^a  

^a NOVARTIS PHARMA AG   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

ARTICLE; BIOAVAILABILITY; BLOOD BRAIN BARRIER; CELL MEMBRANE PERMEABILITY; CELL STRAIN CACO 2; DRUG ABSORPTION; DRUG TRANSPORT; GEOMETRY; INTESTINE ABSORPTION; MEMBRANE TRANSPORT; PASSIVE TRANSPORT;

BIOLOGICAL AVAILABILITY; BIOLOGICAL TRANSPORT; MODELS, MOLECULAR; MOLECULAR STRUCTURE; PHARMACEUTICAL PREPARATIONS; REPRODUCIBILITY OF RESULTS;

EID: 0034609833     PISSN: 00222623     EISSN: None     Source Type: Journal    
DOI: 10.1021/jm000942e     Document Type: Article

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