Databases

57 databases containing 92 134 chemicals with above 2.6 million measured data points are available in QSAR Toolbox 4.4.

apple computer desk 18104 1024x593 - Databases

The databases are grouped in four categories based on the type of information they are providing:

  • physical chemical properties:
    49 422 substances and 224 886 experimental values
    .
  • environmental fate and transport:
    12 728 substances and 140 684 endpoint values
    .
  • ecotoxicological information:
    21 206 substances and 1 115 797 endpoint values
    .
  • human health hazards:
    44 111 substances and 1 153 091 endpoint values
    .

The databases and the main type of metadata they contain are shown in the table below.

The databases and the main type of metadata they contain are shown in the table below.

Physical-Chemical Properties

The endpoints under each category and the databases that contain experimental data for each endpoint are shown in the table below.

Environmental Fate and Transport

Ecotoxicological Information

Human Health Hazard