Combining traditional 2D and modern physical organic-derived descriptors to predict enhanced enantioselectivity for the key aza-Michael conjugate addition in the synthesis of Prevymis™ (letermovir)
Author:
Affiliation:
1. Department of Chemistry
2. University of Utah
3. Salt Lake City
4. USA
5. Modeling and Informatics
6. MRL
7. Merck Sharp & Dohme
8. Rahway
9. Process Research and Development
Abstract
Hybrid QSAR modeling predicts improved catalysts for the synthesis of Prevymis™ (letermovir).
Funder
Division of Chemistry
Publisher
Royal Society of Chemistry (RSC)
Subject
General Chemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2018/SC/C8SC02089B
Reference27 articles.
1. Use of Drug Discovery Tools in Rational Organometallic Catalyst Design
2. Parametrization of Non-covalent Interactions for Transition State Interrogation Applied to Asymmetric Catalysis
3. Mechanistic Investigations of the Pd(0)-Catalyzed Enantioselective 1,1-Diarylation of Benzyl Acrylates
4. QSAR Modeling: Where Have You Been? Where Are You Going To?
5. Predicting and optimizing asymmetric catalyst performance using the principles of experimental design and steric parameters
Cited by 23 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献
1. A genetic optimization strategy with generality in asymmetric organocatalysis as a primary target;Chemical Science;2024
2. A Primer on 2D Descriptors in Selectivity Modeling for Asymmetric Catalysis;Chemistry – A European Journal;2023-12-19
3. Instructions to Authors 2023;CHIMIA;2023-02-22
4. Predicting Highly Enantioselective Catalysts Using Tunable Fragment Descriptors**;Angewandte Chemie International Edition;2023-02-06
5. Predicting Highly Enantioselective Catalysts Using Tunable Fragment Descriptors**;Angewandte Chemie;2023-02-06
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线,采集、加工和组织学术论文而形成的新型学术文献查询和分析系统,可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容,当前同舟云学术共收录了国内外主流学术期刊6万余种,收集的期刊论文及会议论文总量共计约1.5亿篇,并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询!咨询电话:010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3