tox_chemicals {toxEval} | R Documentation |
ToxCast Chemical Information
Description
Downloaded from the CompTox database on October 2022. https://comptox.epa.gov/dashboard/. Additional columns were added based on the information from the "INVITRODB_V3_5_LEVEL5" data.
Value
data frame with the following columns:
Column | Description |
DSSTox_Substance_Id | DSSTox_Substance_Id |
Substance_Name | Commen chemical name |
Structure_MolWt | Molecular weight |
DTXCID | DTXCID |
Substance_CASRN | CASRN |
INCHIKEY | INCHIKEY |
SMILES | SMILES |
Total_tested | Total number of ToxCast assays tested |
Active | Number of ToxCast assays flagged as active |
min_concentration | Minimum concentration tested in ToxCast (ug/L) |
max_concentration | Maximum concentration tested in ToxCast (ug/L) |
data frame with columns: "Substance_Name","Substance_CASRN", "Structure_MolWt"
Examples
head(tox_chemicals)
[Package toxEval version 1.3.2 Index]