Bhhatarai, B.; Gramatica, P. Oral LD50 toxicity modeling and prediction of per- and polyfluorinated chemicals on rat and mouse. Mol. Diversity 2010, 15, 467–476.
Compound
| ID: | 024095-80-5 | |
|---|---|---|
| Name: | 4-Methyl-1-(3,5-bistrifluoromethylphenyl)thiosemicarbazide | |
| Description: | ||
| Labels: | ||
| CAS: | 24095-80-5 | |
| InChi Code: | InChI=1/C10H9F6N3S/c1-17-8(20)19-18-7-3-5(9(11,12)13)2-6(4-7)10(14,15)16/h2-4,18H,1H3,(H2,17,19,20)/f/h17,19H |
Properties
pLD50mouse: Mouse oral toxicity as log(LD50) [-log(mmol/kg)]
| Value | Source or prediction |
|---|---|
| 3.07 |
experimental value |
| 2.97165 |
Eq1: model for 58 polyfluorinated compounds for mouse oral toxicity (train) |
pLD50rat: Rat oral toxicity as log(1/LD50) [-log(mmol/kg)]
| Value | Source or prediction |
|---|---|
| 2.884 |
experimental value |
| 2.816362 |
Eq2: model for 50 polyflourinated compounds for rat oral toxicity (train) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID00178819 | US EPA CompTox Dashboard |