10967/258 - QDB Compounds

QsarDB Repository

Kotli, M.; Piir, G.; Maran, U. Pesticide effect on earthworm lethality via interpretable machine learning. J. Hazard Mater. 2023, 461, 132577

Compound

ID:745.T
Name:2-{[(E)-(6-tert-butyl-2,3-difluorophenyl)[(cyclopropylmethoxy)imino]methyl]carbamoyl}acetic acid
Description:
Labels:
CAS:
InChi Code:InChI=1S/C18H22F2N2O4/c1-18(2,3)11-6-7-12(19)16(20)15(11)17(21-13(23)8-14(24)25)22-26-9-10-4-5-10/h6-7,10H,4-5,8-9H2,1-3H3,(H,24,25)(H,21,22,23)

Properties

toxicity_class: Acute toxicity to earthworm [mg/kg] i

ValueSource or prediction
toxic

experimental value

toxic

rf: Random Forest (toxicity_class.train)

nontoxic

rf: Random Forest (toxicity_class.oob)