linuron

Identification (Source:EPA,EU)

ID 1174
Name linuron
CAS 330-55-2
IUPAC 3-(3,4-dichlorophenyl)-1-methoxy-1-methylurea
Inchi InChI=1S/C9H10Cl2N2O2/c1-13(15-2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)
CIPAC 76
EPA Code 035506
Formula C9H10Cl2N2O2
SMILES Clc1ccc(NC(=O)N(OC)C)cc1Cl
Status Not Approved

Classification

Mode of Action Selective, systemic with contact and residual action. Inhibits photosynthesis (photosystem II)
Pesticide Type Herbicide
Chemical Group Urea
Classification phenylurea herbicides

Properties (Source:PubChem)

Molecular Weight 249.09
Physical State White crystalline solid
AlogP 2.326
H-Bond Donor 1
H-Bond Acceptor 2
Surface Area 234.27
Polar Surface Area 41.57

Structure



ChemMapper Search Option (Docunmentation of ChemMapper)

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 0.016 mg l-1
Algae Chronic 96 hour NOEC, growth 0.01 mg l-1
Aquatic crustaceans Acute 96 hour LC50 2.9 mg l-1
Aquatic invertebrates Acute 48 hour EC50 0.31 mg l-1
Aquatic invertebrates Chronic 21 day NOEC 0.18 mg l-1
Aquatic plants Acute 7 day EC50, biomass 0.017 mg l-1
Birds Short term dietary LC50/LD50 1250 mg/kg feed
Birds Acute LD50 314 mg kg-1
Earthworms Acute 14 day LD50 > 1000 mg kg-1
Fish Chronic 21 day NOEC 0.1 mg l-1
Fish Acute 96 hour LC50 3.15 mg l-1
Honeybees Acute 48 hour LD50 > 160 μg bee-1
Mammals Acute oral LD50 1146 mg kg-1
Mammals Short term dietary NOEL 25 ppm diet
Mammals Short term dietary NOEL 2 mg kg-1
Sediment dwelling organisms Acute 96 hour LC50 10.0 mg l-1
Bio-concentration factor CT50 8 days
Bio-concentration factor BCF 49

Related targets

Target Name RScore (About this table)
androgen receptor 583(5,10,11,28) Details
AhR 74(0,2,3,9) Details
demethylases 69(0,2,3,4) Details
hemoglobin (protein family or complex) 66(0,2,2,6) Details
C18 25(0,0,2,15) Details
cytochrome P450 (protein family or complex) 24(0,0,3,9) Details
aryl hydrocarbon hydroxylase 12(0,0,2,2) Details
Koc 10(0,0,1,5) Details
CYP1B1 7(0,0,1,2) Details
Lag 6(0,0,1,1) Details
proliferating cell nuclear antigen 6(0,0,1,1) Details
muscles 6(0,0,0,6) Details
Myomesin 2 6(0,0,1,1) Details
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