EPN

Identification (Source:EPA,EU)

ID 1567
Name EPN
CAS 2104-64-5
IUPAC
Inchi InChI=1S/C14H15O2PS/c1-2-15-17(18,14-11-7-4-8-12-14)16-13-9-5-3-6-10-13/h3-12H,2H2,1H3
CIPAC 302
EPA Code 041801
Formula C14H14NO4PS
SMILES S=P(Oc1ccc(cc1)[N+]([O-])=O)(OCC)c2ccccc2
Status Not Approved

Classification

Mode of Action Non-systemic with contact and stomach action, works by cholinesterase inhibition
Pesticide Type Insecticide, Acaricide
Chemical Group Organophosphate
Classification phenyl phenylphosphonothioate insecticides
phosphonothioate insecticides

Properties (Source:PubChem)

Molecular Weight 323.30
Physical State Yellow crystals
AlogP 4.082
H-Bond Donor 0
H-Bond Acceptor 3
Surface Area 256.44
Polar Surface Area 60.36

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
Aquatic crustaceans Acute 96 hour LC50 0.003 mg l-1
Aquatic invertebrates Acute 48 hour EC50 0.00006 mg l-1
Birds Acute LD50 289 mg kg-1
Fish Acute 96 hour LC50 0.110 mg l-1
Mammals Acute oral LD50 14 mg kg-1

Related targets

Target Name RScore (About this table)
butyrylcholinesterase 150(1,2,5,25) Details
cytochrome P450 (protein family or complex) 93(1,1,1,13) Details
aminopeptidase 81(1,1,1,1) Details
mitogen activated protein kinase (protein family or complex) 81(1,1,1,1) Details
Acetylcholinesterase 56(0,1,1,26) Details
interleukin 6 38(0,1,2,3) Details
ERK1 34(0,1,1,4) Details
epn 1 32(0,1,1,2) Details
rheumatoid factor 31(0,1,1,1) Details
C type lectin 25(0,0,0,25) Details
estradiol receptor 14(0,0,0,14) Details
C type lectins (protein family or complex) 13(0,0,0,13) Details
DC SIGN 13(0,0,0,13) Details
endocrine gland derived vascular endothelial growth factor 13(0,0,0,13) Details
APPI 13(0,0,2,3) Details
Substance P 12(0,0,2,2) Details
neurotoxic esterase 12(0,0,0,12) Details
RIZ1 11(0,0,0,11) Details
NeuroD1 10(0,0,0,10) Details
Langerin 9(0,0,0,9) Details
Aurora B 9(0,0,0,9) Details
calcitonin 8(0,0,0,8) Details
Mannose Binding Lectin 8(0,0,0,8) Details
TEPP 7(0,0,1,2) Details
CEase 7(0,0,0,7) Details
epiphycan 7(0,0,1,2) Details
biglycan 7(0,0,1,2) Details
asporin 6(0,0,1,1) Details
chromogranin A 6(0,0,0,6) Details
dectin 2 6(0,0,0,6) Details
parvalbumin 6(0,0,0,6) Details
tryptophan pyrrolase 6(0,0,1,1) Details
fibromodulin 6(0,0,1,1) Details
lumican 6(0,0,1,1) Details
vascular endothelial growth factor 5(0,0,0,5) Details
c jun 5(0,0,0,5) Details
cytochrome c 5(0,0,0,5) Details
beta glucuronidase 5(0,0,0,5) Details
Egasyn 5(0,0,0,5) Details
PC3 5(0,0,0,5) Details
PK2 5(0,0,0,5) Details
tryptophan hydroxylase 2 5(0,0,0,5) Details
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