Toropov, A. A.; Benfenati, E. QSAR models of quail dietary toxicity based on the graph of atomic orbitals. Bioorg. Med. Chem. Lett. 2006, 16, 1941–1943.
Compound
| ID: | Va_10 | |
|---|---|---|
| Name: | Pendimethalin | |
| Description: | ||
| Labels: | ||
| CAS: | 40487-42-1 | |
| InChi Code: | InChI=1S/C13H19N3O4/c1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h7,10,14H,5-6H2,1-4H3 |
Properties
pLC50: Quail dietary toxicity as log(1/LC50) [-log(mmol/L)]
| Value | Source or prediction |
|---|---|
| -1.1726 |
experimental value |
| -0.93593 |
Eq.3: Model for pesticides (Validation set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7024245 | US EPA CompTox Dashboard |