ChemInformRX

Access and interface

ChemInformRX database refers to the in-house database (Server ISIS/Host), which is accessible from the network of the faculty via ISIS/Base. Interested persons should contact the IT coordinator of the faculty.

There is the multitude of research opportunities such as substructure research and the similarity research, restriction to the reaction types or reaction conditions. Hit lists can be organized according to the specific criteria (“clustering”). For all of the datasets of the ChemInformRX, the overall reaction schema can be fully shown. The interface and the arrays can be chosen and adapted freely.

The database support was not extended, the database remains on the status 2005! The installation will continue as a teaching database.

Data pool

• Reference Library 2001
  209778 reactions / 270847 structures / from until 1991
• ChemInformRX 9296
  327717 reactions / 378774 structures / from1989 until 1995
• ChemInformRX 9701
  335603 reactions / 393720 structures /  from 1994 until 2000
• ChemInformRX 2002
  68816 reactions / 91715 structures / from2000 until 2001
• ChemInformRX 2003
  74579 reactions / 97346 structures / from2001 until 2002
• ChemInformRX 2004
  71548 reactions / 92295 structures / from2002 until 2003
• ChemInformRX 2005
  71113 reactions / 93415 structures / from2003 until 2004
• ChemInformRX 2006
  38254 reactions / 52629 structures / from2004 until 2005

The databases THEILHEIMER, CLF and CHC, were integrated into REFLIB. In total, over 1,1 million organic chemical reactions are included.