Databases
62 databases containing ~100 000 chemicals with above 3 million measured data points are available in QSAR Toolbox 4.6.
The databases are grouped in four categories based on the type of information they are providing:
- physical chemical properties:
50 771 substances and 251 311 experimental values
. - environmental fate and transport:
15 610 substances and 177 909 endpoint values
. - ecotoxicological information:
23 678 substances and 1 423 889 endpoint values
. - human health hazards:
45 931 substances and 1 367 583 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.