deltamethrin

Identification (Source:EPA,EU)

ID 1610
Name deltamethrin
CAS 52918-63-5
IUPAC
Inchi InChI=1S/C22H19Br2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17-,18+,20-/m0/s1
CIPAC 333
EPA Code 978051
Formula C22H19Br2NO3
SMILES Br/C(Br)=C/[C@H]3[C@@H](C(=O)O[C@H](C#N)c2cccc(Oc1ccccc1)c2)C3(C)C
Status Approved

Classification

Mode of Action Non-systemic with contact and stomach action. Sodium channel modulator.
Pesticide Type Insecticide, Metabolite, Veterinary treatment
Chemical Group Pyrethroid
Classification pyrethroid ester insecticides

Properties (Source:PubChem)

Molecular Weight 505.2
Physical State Colourless crystals
AlogP 5.522
H-Bond Donor 0
H-Bond Acceptor 4
Surface Area 412.06
Polar Surface Area 59.32

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 9.1 mg l-1
Aquatic crustaceans Acute 96 hour LC50 0.0000017 mg l-1
Aquatic invertebrates Acute 48 hour EC50 0.00056 mg l-1
Aquatic invertebrates Chronic 21 day NOEC 0.0041 mg l-1
Birds Acute LD50 > 2250 mg kg-1
Birds Short term dietary LC50/LD50 > 5620 ppm
Earthworms Acute 14 day LD50 > 1290 mg kg-1
Fish Acute 96 hour LC50 0.00026 mg l-1
Fish Chronic 21 day NOEC < 0.032 mg l-1
Honeybees Acute 48 hour LD50 0.0015 μg bee-1
Mammals Acute oral LD50 87 mg kg-1
Mammals Short term dietary NOEL 2.5 mg kg-1
Sediment dwelling organisms Chronic 28 day NOEC, sediment 0.01 mg kg-1
Bio-concentration factor CT50 Not available days
Bio-concentration factor BCF 1400

Related targets

Target Name RScore (About this table)
sodium channel (protein family or complex) 1278(12,16,30,128) Details
cytochrome P450 (protein family or complex) 842(8,10,27,57) Details
calcineurin (protein family or complex) 797(6,14,14,77) Details
Ca v 365(4,5,6,10) Details
cis 3 316(3,5,6,11) Details
Acetylcholinesterase 449(2,6,23,84) Details
ATPase 241(2,3,9,21) Details
bcl 2 233(2,3,9,13) Details
cytochrome c 218(2,2,10,18) Details
CYP1A1 186(2,2,5,11) Details
glutamate receptor 163(2,2,2,3) Details
calcineurin inhibitors 234(1,5,9,14) Details
calmodulin 230(1,5,6,25) Details
chloride channel (protein family or complex) 156(1,3,4,11) Details
G protein 148(1,3,3,8) Details
brain derived neurotrophic factor 154(1,2,8,14) Details
tyrosine hydroxylase 137(1,2,5,12) Details
Cytochrome c oxidase (protein family or complex) 127(1,2,4,7) Details
GABA receptor (protein family or complex) 121(1,2,2,11) Details
protein phosphatase 121(1,2,2,11) Details
NF E2 related factor 2 101(1,1,4,6) Details
somatostatin 97(1,1,2,12) Details
CFTR 93(1,1,1,13) Details
adenylate cyclase 90(1,1,2,5) Details
CYP1A2 89(1,1,1,9) Details
hCE 1 89(1,1,2,4) Details
hemoglobin (protein family or complex) 88(1,1,2,3) Details
monoamine oxidase 84(1,1,1,4) Details
peripheral type benzodiazepine receptors 84(1,1,1,4) Details
calcium channel (protein family or complex) 84(1,1,1,4) Details
protein tyrosine phosphatases 83(1,1,1,3) Details
CYP2D6 83(1,1,1,3) Details
choline acetyltransferase 83(1,1,1,3) Details
S100beta 81(1,1,1,1) Details
somatotropins 81(1,1,1,1) Details
synapsin I 81(1,1,1,1) Details
BIII 81(1,1,1,1) Details
aromatic l amino acid decarboxylase 81(1,1,1,1) Details
IP2 81(1,1,1,1) Details
NMDA receptor (protein family or complex) 129(0,4,4,9) Details
CYP3A4 77(0,2,3,12) Details
serine threonine protein phosphatase 63(0,2,2,3) Details
Salvador 62(0,1,5,12) Details
c fos 62(0,1,6,7) Details
G6PD 60(0,1,4,15) Details
Nav1.4 56(0,1,5,6) Details
c jun 55(0,1,5,5) Details
cytochrome P450 monooxygenase 50(0,1,3,10) Details
PP2A 41(0,1,1,11) Details
thrombin 36(0,1,1,6) Details
glucagon 36(0,1,1,6) Details
estrogen receptors 36(0,1,1,6) Details
Ho 1 34(0,1,1,4) Details
PPase 34(0,1,1,4) Details
Camk1g 33(0,1,1,3) Details
carboxylesterase 1 33(0,1,1,3) Details
GABAT 33(0,1,1,3) Details
hCE 2 32(0,1,1,2) Details
CaM kinase II (protein family or complex) 32(0,1,1,2) Details
cis 1 31(0,1,1,1) Details
annexin V 31(0,1,1,1) Details
Potassium channel (protein family or complex) 31(0,1,1,1) Details
beta adrenoceptor (protein family or complex) 31(0,1,1,1) Details
glutathione S transferase 49(0,0,2,39) Details
P53 30(0,0,5,5) Details
caspase 3 29(0,0,4,9) Details
catalase 28(0,0,3,13) Details
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