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SAR studies on β-cell KATP channel openers
- Source :
- Interdisciplinary Sciences: Computational Life Sciences. 4:215-222
- Publication Year :
- 2012
- Publisher :
- Springer Science and Business Media LLC, 2012.
-
Abstract
- Recently Balaban has introduced a J-type G index for modeling those properties/activities where not only the "shape" but also size of the graph influences the property/activity of organic compounds acting as drugs. Here, for the first time G index has been used for modeling the pancreatic β-cell K(ATP) channel openers viz R/S-3,4-dihydro-2,2-dimethyl-6-halo-4-(substituted phenylaminocarbonylamino)-2H-1-benzopyrans. Modeling technology used in this paper has established that the referred activity is excellently modeled by using G as one of the correlating descriptors. The results are critically discussed using Ridge statistics.
- Subjects :
- Potassium Channels
Channel (digital image)
Stereochemistry
Health Informatics
Models, Theoretical
General Biochemistry, Genetics and Molecular Biology
Computer Science Applications
Benzopyran
Structure-Activity Relationship
chemistry.chemical_compound
chemistry
Insulin-Secreting Cells
Computational Science and Engineering
Benzopyrans
Subjects
Details
- ISSN :
- 18671462 and 19132751
- Volume :
- 4
- Database :
- OpenAIRE
- Journal :
- Interdisciplinary Sciences: Computational Life Sciences
- Accession number :
- edsair.doi.dedup.....21392714f74082521e78fbd558d330b1
- Full Text :
- https://doi.org/10.1007/s12539-012-0135-8