amitraz

Identification (Source:EPA,EU)

ID 155
Name amitraz
CAS 33089-61-1
IUPAC
Inchi InChI=1S/C19H23N3/c1-14-6-8-18(16(3)10-14)20-12-22(5)13-21-19-9-7-15(2)11-17(19)4/h6-13H,1-5H3
CIPAC 362
EPA Code 106201
Formula C19H23N3
SMILES N(=C/N(\C=N\c1ccc(cc1C)C)C)\c2ccc(cc2C)C
Status Not Approved

Classification

Mode of Action Non-systemic having contact and respiratory action. Octopaminergic (nervous system) agonist.
Pesticide Type Insecticide, Acaricide, Veterinary treatment
Chemical Group Amidine
Classification formamidine acaricides
formamidine insecticides

Properties (Source:PubChem)

Molecular Weight 293.41
Physical State Straw coloured crystalline solid
AlogP 4.825
H-Bond Donor 0
H-Bond Acceptor 3
Surface Area 323.56
Polar Surface Area 27.96

Structure



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3D similarity method

2D similarity method

Compound Database



Bioactivity Database

KEGG (5,928)

PDB (7,072)


Similarity Threshold

Ecotoxicology (Source:PPDB,IPM)

Species Method Study Time Dose Type Value
Algae Acute 72 hour EC50, growth 12 mg l-1
Aquatic crustaceans Acute 96 hour LC50 4.7 mg l-1
Aquatic invertebrates Acute 48 hour EC50 0.035 mg l-1
Aquatic invertebrates Chronic 21 day NOEC 0.002 mg l-1
Birds Acute LD50 788 mg kg-1
Earthworms Acute 14 day LD50 1000 mg kg-1
Fish Acute 96 hour LC50 0.74 mg l-1
Honeybees Acute 48 hour LD50 50 μg bee-1
Mammals Acute oral LD50 800 mg kg-1
Mammals Short term dietary NOEL 50 ppm diet
Bio-concentration factor CT50 Not available days
Bio-concentration factor BCF 1838

Related targets

Target Name RScore (About this table)
alpha 2 adrenoreceptor 541(4,10,14,21) Details
glucagon 324(4,4,4,4) Details
monoamine oxidase 115(1,2,2,5) Details
adenylyl cyclase 82(1,1,1,2) Details
estrogen receptors 81(1,1,1,1) Details
adenylate cyclase 81(1,1,1,1) Details
unknowns 81(1,1,1,1) Details
alpha 2 adrenergic receptor (protein family or complex) 114(0,3,6,9) Details
cholinesterase 32(0,1,1,2) Details
G protein 31(0,1,1,1) Details
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Node List

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