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
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
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 |
Docunmentation of Network Visuallization
Network initializing...Please wait
Legend:

: Current entry node;

: Target node;

: Compound node;