Search Result "pKa prediction"
Database Mining for pKa Prediction
Journal: Current Drug Discovery Technologies
Volume: 2 Issue: 4 Year: 2005 Page: 221-229
Author(s): Thierry Kogej, Sorel Muresan
Predicting the pKa of Small Molecules
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 14 Issue: 5 Year: 2011 Page: 307-327
Author(s): Matthias Rupp, Robert Korner, Igor V. Tetko
Calculation Methods for the Enhancement of Pharmaceutical Properties in Small Molecules: Estimating the Cationic pKa
Journal: Current Pharmaceutical Design
Volume: 19 Issue: 2 Year: 2013 Page: 4310-4315
Author(s): Ann R. Hermone, Rick Gussio
Scouting Novel Protein Kinase A (PKA) Inhibitors by Using a Consensus Docking-Based Virtual Screening Approach
Journal: Letters in Drug Design & Discovery
Volume: 6 Issue: 5 Year: 2009 Page: 327-336
Author(s): Nicola Zonta, Giorgio Cozza, Alessandra Gianoncelli, Oliver Korb, Thomas E. Exner, Flavio Meggio, Giuseppe Zagotto, Stefano Moro
Using Measured pKa, LogP and Solubility to Investigate Supersaturation and Predict BCS Class
Journal: Current Drug Metabolism
Volume: 9 Issue: 9 Year: 2008 Page: 869-878
Author(s): K. J. Box, J. E.A. Comer
Determining Partition Coefficient (Log P), Distribution Coefficient (Log D) and Ionization Constant (pKa) in Early Drug Discovery
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 6 Year: 2016 Page: 461-469
Author(s): Sonali S. Bharate,Vikas Kumar,Ram A. Vishwakarma
Predicted Contributions of Flavin-containing Monooxygenases to the N-oxygenation of Drug Candidates Based on their Estimated Base Dissociation Constants
Journal: Current Drug Metabolism
Volume: 22 Issue: 3 Year: 2021 Page: 208-214
Author(s): Tomomi Taniguchi-Takizawa,Harutoshi Kato,Makiko Shimizu,Hiroshi Yamazaki
Prediction of Intracellular Localization of Fluorescent Dyes Using QSAR Models
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 5 Year: 2016 Page: 378-383
Author(s): Shohei Uchinomiya,Richard W. Horobin,Enrique Alvarado-MartÃnez,Eduardo Peña-Cabrera,Young-Tae Chang
Theoretical Property Predictions
Journal: Current Topics in Medicinal Chemistry
Volume: 3 Issue: 1 Year: 2003 Page: 1171-1192
Author(s): David J. Livingstone
Theoretical Property Predictions
Ebook: Young People’s Visions of the World
Volume: 2 Year: 2010
Author(s): David J. Livingston
Doi: 10.2174/97816080520591050201