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:1264.T
Name:4-{N'-tert-butyl-N'-[1-(3,5-dimethylphenyl)ethenyl]hydrazinecarbonyl}benzoic acid
Description:
Labels:
CAS:
InChi Code:InChI=1S/C22H26N2O3/c1-14-11-15(2)13-19(12-14)16(3)24(22(4,5)6)23-20(25)17-7-9-18(10-8-17)21(26)27/h7-13H,3H2,1-2,4-6H3,(H,23,25)(H,26,27)

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)