10967/263 - QDB Compounds

QsarDB Repository

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:2609
Name:(Z)-2-(2-fluoro-5-(trifluoromethyl)phenylsulfinyl)-2-(3,2-methoxyphenyl)thiazolidin-2-ylidene)acetonitrile
Description:
Labels:
CAS:
InChi Code:InChI=1S/C19H14F4N2O2S2/c1-27-15-5-3-2-4-14(15)25-8-9-28-18(25)17(11-24)29(26)16-10-12(19(21,22)23)6-7-13(16)20/h2-7,10H,8-9H2,1H3/b18-17-

Properties

NOEC_class: reproductive toxicity class of No-Observed-Effect Concentration for earthworms i

ValueSource or prediction
toxic

experimental value

nontoxic

modelA: Model A (Training (all))

toxic

modelB: Model B (Training (all))

nontoxic

model_AB: model_AB (Training (all))

NOEC: reproductive toxicity of No-Observed-Effect Concentration for earthworms as mg/kg in soil [mg/kg] i

ValueSource or prediction
25

experimental value