Compounds

• smiles - the smiles string for the compound
  
• name - the name of the compound, either user supplied or the drug name
  
• vendor - the vendor of the compound, this comes from the vender table which is a controlled vocabulary
  
• library - this is a user supplied tag to annotate compounds purchased at different times
  
• catno - the vendor's catalogue number of the compound
  
• mw_total - molecular weight of the compound
  
• mw_active - the molecular weight of the smallest fragment of the compound
  
• num_atoms - the number of atoms in the compound
  
• num_bonds - the number of bonds in the compound

• Substructure Search - Search the current compound view for a substructure.  This command opens up a new dialog box where a substructure can be entered.  If a row is selected, then the view is opened with the substructure from the current row.  Exiting this dialog starts the substructure search.
  
• Find Similar - Sorts the compounds based on their similarity to the currently selected compound.
  
• Locate Plates - Display all the plates where the currently selected compounds are found.
  
• Search - Search for properties in the view
  
• Sort - Sort the view
  
• Export - Export the selected view to a csv file.  This doesn't save images.
  
• Export To Excel - Export the selected view to Excel.  Excel must be installed on your computer.  This really should only be used for relatively small views.
  
• To SDF - Export the current view as a MDL Structured Data File.  This is a standard format for transporting chemical structures and their related data fields.
  
• Load QuickList - Join the current view with the given quicklist.   Used from the compound view, this shows all compounds stored in the quicklist.
  
• Add Compounds - Add Compounds to the database.  This is also how batches are added to the database.