Professional Software for Researchers

ACD/Labs creates innovative software packages that aid chemical research scientists worldwide with spectroscopic validation of structures, elucidation of unknown substances, chromatographic separation, medicinal chemistry, preformulation of novel drug agents, systematic nomenclature generation, and chemical patenting and publication. Our professional industry-strength tools are available to Academia at favorable academic prices. Email education@acdlabs.com to learn more.

A comprehensive listing of our software is located on our Products page. Please also review our Solutions pages to see how our products fit into the modern laboratories, and help advance chemical research in a number of industries.

Among the most popular tools in Academia are:

PhysChem - Our physicochemical property prediction software allows users to draw their structure, click a button, and obtain a myriad of values ranging from general molecular properties to pK_a, LogD, and Aqueous Solubility. Many of the applications contain internal databases of high quality peer reviewed experimental measurements.

Naming - Remove the tedium and gain confidence in generating structures from names, and names from structures with the industry's most accurate and complete implementation of IUPAC recommendations and CAS Index rules.

NMR - ACD/Labs is well-known for the industry standard ¹H, ¹³C, ¹⁵N, ¹⁹F, and ³¹P 1D NMR, and 2D NMR predictors that allow scientists to generate chemical shifts with coupling constants at the click of the mouse. Other NMR products enable vendor-neutral spectrum processing, automatic structure-spectrum verification, structure-enabled databasing, and structure elucidation. You can even build your own database of compounds and fine tune the predictions!

MS - Understand how an ionized molecule fragments under different ionization techniques, from electron ionization (EI) to low energy electrospray ionization (ESI) or atmospheric pressure chemical ionization (APCI). Starting with your initial structure, view a genealogical cascade of predicted fragments that establishes the pathways of fragment generation. Vendor-neutral processing and databasing software offers convenient interface and numerous advanced processing algorithms.

Chromatography - Process, database, simulate, and optimize separations with our chromatography tools. Our software contains a fully structure searchable database of separations that can be united with all your spectroscopy data. Kick-start your method development and explain the fundamentals of chromatography in one software interface!

Contact ACD/Labs at education@acdlabs.com to find out how our software can accelerate your research!