amitrole

Identification (Source:EPA,EU)

ID 1146
Name amitrole
CAS 61-82-5
IUPAC
Inchi InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)
CIPAC 90
EPA Code 004401
Formula C2H4N4
SMILES n1cnnc1N
Status Approved

Classification

Mode of Action Translocated, foliar-acting, non-selective action. Inhibition of lycopene cyclase.
Pesticide Type Herbicide
Chemical Group Triazole
Classification triazole herbicides

Properties (Source:PubChem)

Molecular Weight 84.08
Physical State White crystals
AlogP -0.615
H-Bond Donor 2
H-Bond Acceptor 3
Surface Area 92.56
Polar Surface Area 67.59

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 2.3 mg l-1
Algae Chronic 96 hour NOEC, growth 1 mg l-1
Aquatic crustaceans Acute 96 hour LC50 2.8 mg l-1
Aquatic invertebrates Chronic 21 day NOEC 0.32 mg l-1
Aquatic invertebrates Acute 48 hour EC50 6.1 mg l-1
Aquatic plants Acute 7 day EC50, biomass 2.5 mg l-1
Birds Acute LD50 > 2150 mg kg-1
Birds Short term dietary LC50/LD50 > 5000 ppm
Earthworms Acute 14 day LD50 > 448 mg kg-1
Fish Acute 96 hour LC50 > 1000 mg l-1
Fish Chronic 21 day NOEC 100 mg l-1
Honeybees Acute 48 hour LD50 > 100 μg bee-1
Mammals Acute oral LD50 > 5000 mg kg-1
Bio-concentration factor BCF 2.4
Bio-concentration factor CT50 7 days

Related targets

Target Name RScore (About this table)
lactoperoxidase 572(7,7,7,12) Details
thyroid peroxidase 425(4,7,7,15) Details
catalase 1197(2,3,3,1007) Details
pax 8 174(2,2,4,4) Details
ttf 1 124(1,2,4,4) Details
cytochrome P450 (protein family or complex) 80(0,1,1,50) Details
NKX2 1 42(0,1,2,7) Details
catalase B 36(0,1,1,6) Details
thyroid stimulating hormone receptor 31(0,1,1,1) Details
superoxide dismutase 95(0,0,0,95) Details
xanthine oxidase 36(0,0,0,36) Details
myeloperoxidase 28(0,0,0,28) Details
megalin 25(0,0,0,25) Details
glutathione reductase 25(0,0,0,25) Details
hemoglobin (protein family or complex) 24(0,0,0,24) Details
transferase 15(0,0,1,10) Details
ATR1 14(0,0,0,14) Details
glucose 6 phosphate dehydrogenase 14(0,0,0,14) Details
glutathione S transferase 14(0,0,0,14) Details
alcohol dehydrogenase (protein family or complex) 13(0,0,0,13) Details
aldehyde dehydrogenase (protein family or complex) 12(0,0,0,12) Details
thyroid stimulating hormone (protein family or complex) 12(0,0,1,7) Details
eosinophil peroxidase 12(0,0,0,12) Details
glutathione transferase 11(0,0,0,11) Details
MAPK (protein family or complex) 10(0,0,0,10) Details
caspase 3 10(0,0,0,10) Details
lactate dehydrogenase (protein family or complex) 10(0,0,0,10) Details
methemoglobin 10(0,0,0,10) Details
tumor necrosis factor alpha 10(0,0,0,10) Details
interleukin 1 10(0,0,0,10) Details
Tyrosinase 9(0,0,0,9) Details
NF kappa B 8(0,0,0,8) Details
bradykinin 8(0,0,0,8) Details
brains 8(0,0,0,8) Details
NA K ATPase 8(0,0,1,3) Details
p38 8(0,0,0,8) Details
estrogen receptors 8(0,0,0,8) Details
G6PD 7(0,0,0,7) Details
cytochrome c 7(0,0,0,7) Details
monoamine oxidase 7(0,0,0,7) Details
epidermal growth factor receptor 7(0,0,0,7) Details
yAP 1 7(0,0,0,7) Details
ribosomal protein (protein family or complex) 7(0,0,0,7) Details
CD8 6(0,0,0,6) Details
FMLP 6(0,0,0,6) Details
TM3 6(0,0,1,1) Details
beta TrCP 6(0,0,0,6) Details
myostatin 6(0,0,0,6) Details
Atf1 6(0,0,0,6) Details
albumin 6(0,0,0,6) Details
P glycoprotein 6(0,0,0,6) Details
glutamine synthetase 6(0,0,0,6) Details
ERK2 6(0,0,0,6) Details
ceases 6(0,0,1,1) Details
PC3 5(0,0,0,5) Details
insulin like growth factor binding protein 1 5(0,0,0,5) Details
glycerol kinase 5(0,0,0,5) Details
LDLR 5(0,0,0,5) Details
PK1 5(0,0,0,5) Details
c fos 5(0,0,0,5) Details
CYP1A1 5(0,0,0,5) Details
beta endorphin 5(0,0,0,5) Details
clusterin 5(0,0,0,5) Details
azoreductase 4(0,0,0,4) Details
RAP1 4(0,0,0,4) Details
EDRF 4(0,0,0,4) Details
CYP2E1 4(0,0,0,4) Details
Ki ras 4(0,0,0,4) Details
EBS1 4(0,0,0,4) Details
GSHPx 1 4(0,0,0,4) Details
apoprotein 3(0,0,0,3) Details
heme oxygenase 1 3(0,0,0,3) Details
AQP2 3(0,0,0,3) Details
survivin 3(0,0,0,3) Details
GLI1 3(0,0,0,3) Details
ras oncogene (protein family or complex) 3(0,0,0,3) Details
D amino acid oxidase 3(0,0,0,3) Details
arg 2 3(0,0,0,3) Details
ARF1 3(0,0,0,3) Details
CESR 3(0,0,0,3) Details
c Jun N terminal kinase 1 3(0,0,0,3) Details
acid phosphatase 3(0,0,0,3) Details
beta glucuronidase 3(0,0,0,3) Details
glucose 6 phosphatase 3(0,0,0,3) Details
prion protein 3(0,0,0,3) Details
CD4 3(0,0,0,3) Details
AP 1 (protein family or complex) 3(0,0,0,3) Details
guanylate cyclase 3(0,0,0,3) Details
interferon gamma 3(0,0,0,3) Details
thioredoxin 3(0,0,0,3) Details
gastric alcohol dehydrogenase 2(0,0,0,2) Details
5 lipoxygenase 2(0,0,0,2) Details
erythropoietin 2(0,0,0,2) Details
TLR4 2(0,0,0,2) Details
epidermal growth factor 2(0,0,0,2) Details
aquaporins (protein family or complex) 2(0,0,0,2) Details
cyclin 2(0,0,0,2) Details
acetolactate synthase 2(0,0,0,2) Details
NAGA 2(0,0,0,2) Details
eIF3e 2(0,0,0,2) Details
HA1 2(0,0,0,2) Details
TGN38 2(0,0,0,2) Details
heparan sulfate proteoglycans 2(0,0,0,2) Details
endonuclease G 2(0,0,0,2) Details
delta aminolevulinate dehydratase 2(0,0,0,2) Details
polyamine oxidases 2(0,0,0,2) Details
eIF 4E 2(0,0,0,2) Details
WD protein 2(0,0,0,2) Details
muscles 2(0,0,0,2) Details
protein kinase A (protein family or complex) 2(0,0,0,2) Details
epoxide hydrolase 2(0,0,0,2) Details
metallothionein (protein family or complex) 2(0,0,0,2) Details
caspase (protein family or complex) 2(0,0,0,2) Details
CYP1A2 2(0,0,0,2) Details
Ha ras 2(0,0,0,2) Details
P27 2(0,0,0,2) Details
c Jun N terminal kinase (protein family or complex) 2(0,0,0,2) Details
angiotensin II 2(0,0,0,2) Details
SNAP 2(0,0,0,2) Details
AP 2 2(0,0,0,2) Details
tyrosine hydroxylase 2(0,0,0,2) Details
Atrial natriuretic peptide 2(0,0,0,2) Details
TFIID 2(0,0,0,2) Details
ubiquitin 2(0,0,0,2) Details
Diamine oxidase 2(0,0,0,2) Details
lipoxygenases (protein family or complex) 2(0,0,0,2) Details
phospholipase A2 1(0,0,0,1) Details
glutamyl transpeptidase 1(0,0,0,1) Details
IL 5 1(0,0,0,1) Details
Connexin 43 1(0,0,0,1) Details
isocitrate dehydrogenase 1(0,0,0,1) Details
ATPase 1(0,0,0,1) Details
ERK1 1(0,0,0,1) Details
interleukin 6 1(0,0,0,1) Details
interleukin 2 1(0,0,0,1) Details
interleukin 4 1(0,0,0,1) Details
IgE 1(0,0,0,1) Details
G protein 1(0,0,0,1) Details
Potassium channel (protein family or complex) 1(0,0,0,1) Details
complex I 1(0,0,0,1) Details
Mu opioid receptor 1(0,0,0,1) Details
succinate dehydrogenase (protein family or complex) 1(0,0,0,1) Details
CR 2 1(0,0,0,1) Details
cytochrome b 1(0,0,0,1) Details
calpain (protein family or complex) 1(0,0,0,1) Details
c jun 1(0,0,0,1) Details
tyrosine aminotransferase 1(0,0,0,1) Details
CYP2A 1(0,0,0,1) Details
Ah receptor 1(0,0,0,1) Details
H2 receptor 1(0,0,0,1) Details
CD1 1(0,0,0,1) Details
protein is 1(0,0,0,1) Details
cytochrome b5 1(0,0,0,1) Details
cyclin E 1(0,0,0,1) Details
PARP 1(0,0,0,1) Details
ferritin (protein family or complex) 1(0,0,0,1) Details
SP2 1(0,0,0,1) Details
interleukin (protein family or complex) 1(0,0,0,1) Details
AQP3 1(0,0,0,1) Details
alpha fetoprotein 1(0,0,0,1) Details
G beta 1(0,0,0,1) Details
protein a 1(0,0,0,1) Details
malate dehydrogenase 1(0,0,0,1) Details
PR1 1(0,0,0,1) Details
IL 1 alpha 1(0,0,0,1) Details
cytochrome P 450 reductase 1(0,0,0,1) Details
gamma glutamylcysteine synthetase 1(0,0,0,1) Details
CD18 1(0,0,0,1) Details
annexin V 1(0,0,0,1) Details
cathepsin L 1(0,0,0,1) Details
AQP4 1(0,0,0,1) Details
thyroid hormone receptor (protein family or complex) 1(0,0,0,1) Details
transthyretin 1(0,0,0,1) Details
sodium iodide symporter 1(0,0,0,1) Details
cyclin dependent kinase (protein family or complex) 1(0,0,0,1) Details
synapsin I 1(0,0,0,1) Details
saccharopine dehydrogenase 1(0,0,0,1) Details
Leu 2 1(0,0,0,1) Details
orexin 1(0,0,0,1) Details
3 hydroxy 3 methylglutaryl CoA reductase 1(0,0,0,1) Details
serine threonine protein phosphatases 1(0,0,0,1) Details
heat shock protein 72 1(0,0,0,1) Details
protein phosphatases 1(0,0,0,1) Details
endothelial nitric oxide synthase 1(0,0,0,1) Details
tetrahydrofolate synthase 1(0,0,0,1) Details
kidney injury molecule 1 1(0,0,0,1) Details
reelin 1(0,0,0,1) Details
leu 5 1(0,0,0,1) Details
Cat 3 1(0,0,0,1) Details
palmitoyl CoA oxidase 1(0,0,0,1) Details
AQP1 1(0,0,0,1) Details
ADP ribosylation factor 1 1(0,0,0,1) Details
Monoamine oxidase as 1(0,0,0,1) Details
Glutathione S transferase pi 1(0,0,0,1) Details
mitochondrial carrier proteins 1(0,0,0,1) Details
HSP71 1(0,0,0,1) Details
GCN1 1(0,0,0,1) Details
cytolysin 1(0,0,0,1) Details
leucyl tRNA synthetase 1(0,0,0,1) Details
RPL25 1(0,0,0,1) Details
CRY1 1(0,0,0,1) Details
flavin reductases 1(0,0,0,1) Details
acid lipase 1(0,0,0,1) Details
peripheral type benzodiazepine receptors 1(0,0,0,1) Details
histamine H1 receptors 1(0,0,0,1) Details
leucyl tRNA synthetases 1(0,0,0,1) Details
peroxisomal antioxidant enzyme 1(0,0,0,1) Details
uORF 1(0,0,0,1) Details
fumarase 1(0,0,0,1) Details
RACK1 1(0,0,0,1) Details
Tie 2 1(0,0,0,1) Details
CPA1 1(0,0,0,1) Details
Hb 1 1(0,0,0,1) Details
GCN2 1(0,0,0,1) Details
Cs 1 1(0,0,0,1) Details
protein tyrosine phosphatases 1(0,0,0,1) Details
type I iodothyronine deiodinase 1(0,0,0,1) Details
5 methyltetrahydrofolate homocysteine methyltransferase 1(0,0,0,1) Details
endocytic receptor (protein family or complex) 1(0,0,0,1) Details
A23 1(0,0,0,1) Details
Cox 2 1(0,0,0,1) Details
amino acid transporter 1(0,0,0,1) Details
GTP binding proteins 1(0,0,0,1) Details
threonine dehydratase 1(0,0,0,1) Details
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