Kotli, M.; Piir, G.; Maran, U. Predictive Modeling of Pesticides Reproductive Toxicity in Earthworms Using Interpretable Machine-Learning Techniques on Imbalanced Data. ACS Omega 2025, 10, 4732–4744.
Compound
| ID: | 994 | |
|---|---|---|
| Name: | 2-chloro-5((E)-((2RS)-2-hydroxy-3,3-dimethyl-2-(1H-1,2,4-triazole-1-ylmethyl)cyclopentylidenc)methyl)phenol | |
| Description: | ||
| Labels: | ||
| CAS: | ||
| InChi Code: | InChI=1S/C17H20ClN3O2/c1-16(2)6-5-13(7-12-3-4-14(18)15(22)8-12)17(16,23)9-21-11-19-10-20-21/h3-5,8,10-11,22-23H,6-7,9H2,1-2H3/t17-/m0/s1 |
Properties
NOEC_class: reproductive toxicity class of No-Observed-Effect Concentration for earthworms i
| Value | Source or prediction |
|---|---|
| nontoxic |
experimental value |
| nontoxic |
modelA: Model A (Validation) |
| nontoxic |
modelB: Model B (Training (under sampled)) |
| nontoxic |
modelB: Model B (Training (all)) |
NOEC: reproductive toxicity of No-Observed-Effect Concentration for earthworms as mg/kg in soil [mg/kg] i
| Value | Source or prediction |
|---|---|
| 125 |
experimental value |