Estimating the Water Solubilities of Crystalline Compounds from Their Chemical Structures Alone
Author:
Affiliation:
1. reckon.dat consulting, 217 Blood Street, Lyme, Connecticut 06371-3509
2. pION INC., 5 Constitution Way, Woburn, Massachusetts 01801
3. Institute of Physiologically Active Compounds, Chernogolovka, Moscow Region, 142432, Russia
Publisher
American Chemical Society (ACS)
Subject
Computational Theory and Mathematics,Computer Science Applications,Information Systems,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/ci0102822
Reference24 articles.
1. Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings
2. Solubility and partitioning I: Solubility of nonelectrolytes in water
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