niclosamide
Identification (Source:EPA,EU)
ID |
1671 |
Name |
niclosamide |
CAS |
50-65-7 |
IUPAC |
2′,5-dichloro-4′-nitrosalicylanilide |
Inchi |
InChI=1S/C13H8Cl2N2O4/c14-7-1-4-12(18)9(5-7)13(19)16-11-3-2-8(17(20)21)6-10(11)15/h1-6,18H,(H,16,19) |
CIPAC |
599 |
EPA Code |
|
Formula |
C13H8Cl2N2O4 |
SMILES |
c1(C(Nc2c(cc([N+](=O)[O-])cc2)Cl)=O)c(ccc(c1)Cl)O |
Status |
Not Available |
Classification
Mode of Action |
Respiratory & stomach action. Acts by uncoupling oxidative phosphorylation in the tapeworm |
Pesticide Type |
Fungicide, Molluscide, Nematicide, Veterinary treatment |
Chemical Group |
Chloronitrophenol |
Classification |
Molluscicides
|
Properties (Source:PubChem)
Molecular Weight |
327.12 |
Physical State |
Yellow-grey coloured crystalline solid |
AlogP |
3.595 |
H-Bond Donor |
2 |
H-Bond Acceptor |
4 |
Surface Area |
290.52 |
Polar Surface Area |
95.15 |
Structure
Ecotoxicology (Source:PPDB,IPM)
Species |
Method |
Study Time |
Dose Type |
Value |
Algae |
Acute |
72 hour |
EC50, growth |
5.0 mg l-1 |
Aquatic invertebrates |
Acute |
48 hour |
EC50 |
0.2 mg l-1 |
Birds |
Acute |
|
LD50 |
> 2000 mg kg-1 |
Fish |
Acute |
96 hour |
LC50 |
0.34 mg l-1 |
Mammals |
Acute oral |
|
LD50 |
> 5000 mg kg-1 |
Sediment dwelling organisms |
Acute |
96 hour |
LC50 |
1.6 mg l-1 |
|
Bio-concentration factor |
|
BCF |
250 |
|
Bio-concentration factor |
|
CT50 |
ND days |
Related targets
Target Name |
RScore (About this table) |
|
SARS
|
181(2,2,3,16) |
Details |
CYP2C9
|
166(2,2,2,6) |
Details |
IkappaBalpha
|
82(1,1,1,2) |
Details |
CBF1
|
82(1,1,1,2) |
Details |
IkappaB kinase
|
81(1,1,1,1) |
Details |
TAK1
|
81(1,1,1,1) |
Details |
beta catenin
|
81(1,1,1,1) |
Details |
transferrin
|
81(1,1,1,1) |
Details |
CYP1A2
|
35(0,1,1,5) |
Details |
beta 2 adrenergic receptor
|
31(0,1,1,1) |
Details |
Dishevelled 2
|
31(0,1,1,1) |
Details |
demethylase
|
31(0,1,1,1) |
Details |
muscles
|
19(0,0,3,4) |
Details |
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