ChemDraw - PerkinElmer€¦ · ChemDraw Prime is your everyday work horse solution for saving ....

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Discover Why More Than a Million Scientists Rely on ChemDraw The Gold Standard for Chemical Communications From a simple drawing tool to a chemically intelligent application, ChemDraw ® has evolved into the software chemists and research scientists rely on. Whether you’re an experienced chemist or an aspiring one, ChemDraw allows you to find your way around chemistry without having to master drawing. If you’re an old hand with ChemDraw, you can jump straight to “What’s New” by clicking here. If ChemDraw is new to you, why don’t you start here and explore the 3 + 1 versions of the software. Select the one that’s perfect for your needs. ChemDraw Prime ChemDraw Prime is your everyday work horse solution for saving time drawing and publishing your experiments. Here are some of the key features: • Hotkeys: create molecules and reactions as fast as you can type. A navigation hotkey allows you to quickly select and jump from one molecule to another. • Chemical properties calculations: quickly calculate important properties like Molecular Weight, Exact Mass, Chemical Formula and Elemental Analysis but also display the stereochemistry of your molecules. • Structure and Reaction clean-up: do not worry about how your molecules and reactions look, a smart clean-up tool for molecules and reactions allows you to make them ready for publication and presentation prime time. ChemDraw Professional ChemDraw Professional builds on the solid foundation of ChemDraw Prime to empower chemists and biologists to visualize and capture their research, efficiently keep track of their work, and gain a deeper understanding of their results – for better, more confident decisions. ChemDraw Professional includes all the features of ChemDraw Prime plus: • New Ring Coloring options: Make your research stand out and communicate more clearly with new color fill options for carbon cycles. • Name-To-Structure and Structure-To-Name: Instantly generate an accurate chemical structure from a common/IUPAC chemical name or vice-versa. 1 H and 13 C NMR Prediction: Select molecules and visualize what their 1H and 13C NMR spectra might look like. You can also select between CDCl 3 and DMSO-d 6 as a solvent, and configure the frequency of the spectrometer. • SciFinder and Reaxys integrations: Draw a molecule or a reaction in ChemDraw, and initiate a structure search directly into SciFinder, Reaxys, and now SciFinder n . • HELM Toolar: Easily depict, custom define, and share complex biomolecules using the Pistoia Alliance's Hierarchical Editing Language for Macromolecules (HELM) toolbar. ChemDraw ® Figure 1. You can count on ChemDraw’s chemical intelligence to make your structures look their best for presentations and publications. Figure 2. Chemistry doesn’t have to be black & white anymore! Research is more effectively communicated with colors.

Transcript of ChemDraw - PerkinElmer€¦ · ChemDraw Prime is your everyday work horse solution for saving ....

Page 1: ChemDraw - PerkinElmer€¦ · ChemDraw Prime is your everyday work horse solution for saving . time drawing and publishing your experiments. Here are some of the key features: •

Discover Why More Than a Million Scientists Rely on ChemDrawThe Gold Standard for Chemical Communications

From a simple drawing tool to a chemically intelligent application, ChemDraw® has evolved into the software chemists and research scientists rely on. Whether you’re an experienced chemist or an aspiring one, ChemDraw allows you to find your way around chemistry without having to master drawing.

If you’re an old hand with ChemDraw, you can jump straight to “What’s New” by clicking here.

If ChemDraw is new to you, why don’t you start here and explore the 3 + 1 versions of the software. Select the one that’s perfect for your needs.

ChemDraw Prime

ChemDraw Prime is your everyday work horse solution for saving time drawing and publishing your experiments. Here are some of the key features:

• Hotkeys: create molecules and reactions as fast as you can type. A navigation hotkey allows you to quickly select and jump from one molecule to another.

• Chemical properties calculations: quickly calculate important properties like Molecular Weight, Exact Mass, Chemical Formula and Elemental Analysis but also display the stereochemistry of your molecules.

• Structure and Reaction clean-up: do not worry about how your molecules and reactions look, a smart clean-up tool for molecules and reactions allows you to make them ready for publication and presentation prime time.

ChemDraw Professional

ChemDraw Professional builds on the solid foundation of ChemDraw Prime to empower chemists and biologists to visualize and capture their research, efficiently keep track of their work, and gain a deeper understanding of their results – for better, more confident decisions.

ChemDraw Professional includes all the features of ChemDraw Prime plus:

• New Ring Coloring options: Make your research stand out and communicate more clearly with new color fill options for carbon cycles.

• Name-To-Structure and Structure-To-Name: Instantly generate an accurate chemical structure from a common/IUPAC chemical name or vice-versa.

• 1H and 13C NMR Prediction: Select molecules and visualize what their 1H and 13C NMR spectra might look like. You can also select between CDCl3 and DMSO-d6 as a solvent, and configure the frequency of the spectrometer.

• SciFinder and Reaxys integrations: Draw a molecule or a reaction in ChemDraw, and initiate a structure search directly into SciFinder, Reaxys, and now SciFindern.

• HELM Toolar: Easily depict, custom define, and share complex biomolecules using the Pistoia Alliance's Hierarchical Editing Language for Macromolecules (HELM) toolbar.

ChemDraw®

Figure 1. You can count on ChemDraw’s chemical intelligence to make your structures look their best for presentations and publications.

Figure 2. Chemistry doesn’t have to be black & white anymore! Research is more effectively communicated with colors.

Page 2: ChemDraw - PerkinElmer€¦ · ChemDraw Prime is your everyday work horse solution for saving . time drawing and publishing your experiments. Here are some of the key features: •

ChemOffice Professional

ChemOffice Professional contains all the features of ChemDraw Professional plus access to Signals Notebook Individual Edition, a cloud-based Electronic Lab Notebook, Mestrelab’s MNova ChemDraw Edition, powerful add-ins like ChemACX Explorer and the new Pubchem GHS Look-up. You can also custom develop your own add-ins to make ChemDraw even more powerful.

• Pubchem GHS Laboratory Chemical Safety Sheet (LCSS): Select a molecule to immediately visualize GHS pictograms, Hazard Statements and Precautionary Statement Codes from the comfort of ChemDraw. PubChem’s extensive collection provides information from major chemical safety agencies in the World.

• ChemACX Explorer: Browse across more than 10 M commercially available compounds by structure, or CAS RN for supplier information and pricing, chemical properties.

• Signals Notebook Individual Edition: Easily manage, search and share your experiments using a modern Cloud application designed for chemical research, naturally powered by ChemDraw.

• Mestrenova ChemDraw Edition: load and process 1D NMR and LC/GC/MS data directly on your desktop with MNova ChemDraw Edition.

• Shared HELM libraries: if you are into HELM notation, you can use ChemDraw to centrally manage, curate and share libraries of molecules within your own organization for better accuracy and reliable science.

Which Version is Right for Me?

Figure 3. Everything a chemist can need: safety and supplier information (including pricing) available directly from ChemDraw with the new ChemACX Explorer and Pubchem add-ins.

Figure 4. Make your web applications ChemDraw smart by embedding the power of ChemDraw JS, like Elsevier Reaxys or PerkinElmer Signals Notebook.

ChemDraw JavaScript (ChemDraw JS)

ChemDraw JS is a modern web version of ChemDraw, ready to be embedded into your applications to make them ChemDraw-smart. Built on JavaScript and HTML5, ChemDraw JS can be plugged into web browsers and internal applications that need to be “chemicalized.” ChemDraw JS carries the core functionality of the ChemDraw family including: your favorite drawing capabilities, advanced Name to Structure, Structure to Name, Hotkeys/Shortcuts, Structure Templates and Structure Query Tools, and of course an extensive API to integrate within your key research applications.

Product Compatibility

ChemDraw and ChemOffice 19.0 are qualified against the following:

• Windows 7 Professional and Ultimate (32-bit and 64-bit)

• Windows 8.1 (64-bit)

• Windows 10 (64-bit)*

• Microsoft Office 2016 (32-bit and 64-bit)*

• Microsoft Office 2019 (32-bit and 64-bit)*

• Office 365* (* Latest update used for testing is 2002 (12527 20278))

• 10.14 (Mojave), and 10.15 (Catalina)

• Microsoft Office 2016**

• Microsoft Office 2019**

• Office 365** (**The latest Office for Mac update used for testing is 16.29.1 (19091700))

What’s New

All versions of ChemDraw are continuously updated and improved. Click here to go directly to the ChemDraw “What’s New” web page.

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Get all the details in this chart to choose the ChemDraw that’s best for your work.

Summary

New Features PlatformChemDraw Prime ChemDraw

ProfessionalChemOffice Professional

Hotkey Enhancements Win/Mac X X X

Unified Brackets Win/Mac X X X

Ring Fill Coloring Win/Mac X X

Search into SciFinder-n Win/Mac X X

PubChem GHS Add-in Win/Mac X

ChemDraw Add-ins: Authentication Support Win/Mac X

Recent Additions PlatformChemDraw

PrimeChemDraw Professional

ChemOffice Professional

New features Platform ChemDraw Prime ChemDraw Professional ChemOffice Professional

Aromatic cycle display toggle Win/Mac X X X

Hotkey Enhancements Win/Mac X X X

Smart Copy/Paste Win/Mac X X X

Stereochemistry Handling Improvements Win/Mac X X X

HELM 2.0 Support Win/Mac X X

Search into Reaxys Win/Mac X X

Search into SciFinder-n Win/Mac X X

IUPAC-based Atom Numbering Win/Mac X X

Add-ins Dynamic Download Win/Mac X

ChemACX Explorer Win/Mac X

Table 2. Recent Additions.

New features PlatformChemDraw

PrimeChemDraw Professional

ChemOffice Professional

Hotkey Enhancements Win/Mac X X X

Rotation Shortcut Win/Mac X X X

4K Display Support Win/Mac X X X

Ring Fill Coloring Win/Mac X X

PubChem GHS Add-in Win/Mac X

Add-ins Authentication Support Win/Mac X

Table 1. New Features

Includes PlatformChemDraw

PrimeChemDraw Professional

ChemOffice Professional

ChemDraw Win/Mac X X X

Multiple ChemDraw Items Folders Win/Mac X X X

Save and Read Graphic Files Win/Mac X X X

Save and Read Chemical Files Win/Mac X X X

Printing Options Win/Mac X X X

Chemical Templates Win/Mac X X X

Equipment Templates Win/Mac X X X

Analyze/Check Structures Win/Mac X X X

Insert OLE Object in ChemDraw Win X X X

In-place OLE Editing of ChemDraw Objects Win X X X

Show Stereochemistry Win/Mac X X X

Relative Stereochemistry (ISIS compatibility) Win/Mac X X X

Reaction Interpretation Win/Mac X X X

Reaction Mapping Win/Mac X X X

Calculate Properties Win/Mac X X X

Document Tagging Win/Mac X X X

Manual spectrum/structure assignments Win/Mac X X X

Chemical Polymer Tools Win/Mac X X X

Structure Clean Up Win/Mac X X X

Hotkeys Win/Mac X X X

Expand/Contract Labels Win/Mac X X X

Table 3. ChemDraw features by Level.

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Includes PlatformChemDraw

PrimeChemDraw Professional

ChemOffice Professional

Create/Use Nicknames Win/Mac X X X

Expand Generic Structure Win/Mac X X X

Multicenter Attachments Win/Mac X X X

TLC/GEP Tools Win/Mac X X X

Fragmentation Tools Win/Mac X X X

ChemDraw Active X Plugin Win X X X

Copy/Paste as SMILES Win/Mac X X X

Copy/Paste as SYBYL (SLN) Win/Mac X X X

Copy/Paste as InChI Win/Mac X X X

Copy/Paste as Molfile/Mol3000 Win/Mac X X X

Copy/Paste as CDXML Win/Mac X X X

pKa LogP LogS Win/Mac X X X

tPSA Win/Mac X X X

Advanced Retrosynthesis Tool Win/Mac X X

Auto-numbering of multiple structures Win/Mac X X

Search SciFinder Win/Mac X X

Name = Structure/Structure = Name Win/Mac X X

cLogP Win/Mac X X

Biopolymer Toolbar Win/Mac X X

BioDraw Win/Mac X X

Support for HELM Notation Win/Mac X X

CAS RN to Structure from ChemACX.com Win/Mac X X

IUPAC name-based Atom Numbering Win/Mac X X

PerkinElmer Signals™ Notebook Individual Edition

Win/Mac* X

Mnova ChemDraw Edition Win/Mac X

ChemDraw Add-ins Win/Mac X

ChemDraw JS (with Site Subscription Only) Win/Mac X

Reaction Stoichiometry Grid Win/Mac X X

Calculate 1H 13C NMR Spectra Win/Mac X X

Query Features Win/Mac X X

Query Tools Win/Mac X X

Advanced Stereochemistry Win/Mac X X

Paste as HELM Win/Mac X X

Create Sequence Win/Mac X X

Create New Monomer Win/Mac X X

Copy as HELM Win/Mac X X

ChemDraw Cloud Win/Mac* X X

ChemFinder (Std in CD Prof; Ultra in CO) Win X X

ChemDraw for Excel Win X X

Name=Struct for ChemDraw for Excel Win X X

ChemScript + Python Win X X

CombiChem for Excel Win X X

Table 4. ChemDraw features by Level - Continued.

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PerkinElmer, Inc. 940 Winter Street Waltham, MA 02451 USA P: (800) 762-4000 or (+1) 203-925-4602www.perkinelmer.com

Every chemist is an artist with ChemDraw. Join more than a million chemists who love ChemDraw and take your science to the next level. The automation tools and integrations with all the most used chemical libraries offered in ChemDraw streamline drawing and publishing so you can focus on your experiments.

Includes PlatformChemDraw

PrimeChemDraw Professional

ChemOffice Professional

3D Search Win X X

Chem3D (Pro in CDPro; Ultra in CO) Win X X

Chem3D Hotlink Win X X

Chem3D Active X Plugin Win X X

Interface to Conflex Win X

Interface to Autodock Win X

ChemFinder / Oracle Win X

Interface to GAMESS 18 Win X

Interface to Gaussian 16W Win X

Interface to MOPAC 2016 Win X

ChemFinder for Office Win X

Explorer Window View in ChemFinder Ultra Win X

BioViz in ChemFinder Ultra Win X

Compound Profiles in ChemFinder Ultra Win X

Clustering in ChemFinder Ultra Win X

Combine ChemFinder Query Hit Lists Win X

ChemFinder exports to MS Word / Excel Win X

*Access to ChemDraw Cloud and Signals Notebook is provided for one year and can be renewed if current with maintenance.