vinclozolin
Identification (Source:EPA,EU)
| ID |
583 |
| Name |
vinclozolin |
| CAS |
50471-44-8 |
| IUPAC |
|
| Inchi |
InChI=1S/C12H9Cl2NO3/c1-3-12(2)10(16)15(11(17)18-12)9-5-7(13)4-8(14)6-9/h3-6H,1H2,2H3 |
| CIPAC |
280 |
| EPA Code |
113201 |
| Formula |
C12H9Cl2NO3 |
| SMILES |
O=C2OC(C(=O)N2c1cc(Cl)cc(Cl)c1)(\C=C)C |
| Status |
Not Approved |
Classification
Properties (Source:PubChem)
| Molecular Weight |
286.11 |
| Physical State |
Colourless crystals |
| AlogP |
3.662 |
| H-Bond Donor |
0 |
| H-Bond Acceptor |
3 |
| Surface Area |
253.84 |
| Polar Surface Area |
46.61 |
Structure
Ecotoxicology (Source:PPDB,IPM)
| Species |
Method |
Study Time |
Dose Type |
Value |
| Algae |
Acute |
72 hour |
EC50, growth |
1.02 mg l-1 |
| Aquatic crustaceans |
Acute |
96 hour |
LC50 |
1.5 mg l-1 |
| Aquatic invertebrates |
Acute |
48 hour |
EC50 |
3.65 mg l-1 |
| Aquatic plants |
Acute |
7 day |
EC50, biomass |
0.9 mg l-1 |
| Birds |
Acute |
|
LD50 |
5629 mg kg-1 |
| Earthworms |
Acute |
14 day |
LD50 |
1000 mg kg-1 |
| Fish |
Acute |
96 hour |
LC50 |
2.84 mg l-1 |
| Honeybees |
Acute |
48 hour |
LD50 |
100 μg bee-1 |
| Mammals |
Acute oral |
|
LD50 |
> 15000 mg kg-1 |
| Mammals |
Short term dietary |
|
NOEL |
2.8 mg kg-1 |
| Mammals |
Short term dietary |
|
NOEL |
50.0 ppm diet |
|
Bio-concentration factor |
|
BCF |
6.5 |
|
Bio-concentration factor |
|
CT50 |
Not available days |
Related targets
| Target Name |
RScore (About this table) |
|
|
androgen receptors
|
2242(19,39,42,107) |
Details |
|
cytochrome P450 (protein family or complex)
|
156(1,3,4,11) |
Details |
|
ERbeta
|
113(1,2,2,3) |
Details |
|
estrogen receptor
|
112(1,1,3,22) |
Details |
|
E14
|
99(1,1,4,4) |
Details |
|
C18
|
85(1,1,1,5) |
Details |
|
phosphodiesterase
|
81(1,1,1,1) |
Details |
|
BC2
|
81(1,1,1,1) |
Details |
|
TRPM 2
|
45(0,1,3,5) |
Details |
|
vascular endothelial growth factor
|
39(0,1,1,9) |
Details |
|
hormone receptor
|
35(0,1,1,5) |
Details |
|
PC3
|
34(0,1,1,4) |
Details |
|
Ah receptor
|
32(0,1,1,2) |
Details |
|
Bravo
|
31(0,1,1,1) |
Details |
|
progesterone receptor
|
33(0,0,5,8) |
Details |
|
P60
|
19(0,0,3,4) |
Details |
|
CYP1A1
|
19(0,0,3,4) |
Details |
|
CD1
|
19(0,0,3,4) |
Details |
|
G6PD
|
14(0,0,2,4) |
Details |
|
glucose 6 phosphate dehydrogenase
|
12(0,0,2,2) |
Details |
|
CYP19
|
9(0,0,1,4) |
Details |
|
follicle stimulating hormone (protein family or complex)
|
9(0,0,1,4) |
Details |
|
brains
|
8(0,0,1,3) |
Details |
|
E16
|
7(0,0,1,2) |
Details |
|
DINP
|
7(0,0,0,7) |
Details |
|
apoprotein
|
7(0,0,1,2) |
Details |
|
fibroblast growth factor 10
|
6(0,0,1,1) |
Details |
|
CYP2B
|
6(0,0,1,1) |
Details |
|
P450scc
|
5(0,0,0,5) |
Details |
|
glutathione S transferase
|
3(0,0,0,3) |
Details |
|
muscles
|
3(0,0,0,3) |
Details |
|
glucocorticoid receptors
|
3(0,0,0,3) |
Details |
|
NT3
|
3(0,0,0,3) |
Details |
|
aspartate aminotransferase
|
2(0,0,0,2) |
Details |
|
CDC2
|
2(0,0,0,2) |
Details |
|
H19
|
2(0,0,0,2) |
Details |
|
Retinol binding protein
|
2(0,0,0,2) |
Details |
|
GRP78
|
2(0,0,0,2) |
Details |
|
ornithine decarboxylase
|
2(0,0,0,2) |
Details |
|
demethylase
|
2(0,0,0,2) |
Details |
|
CD14
|
1(0,0,0,1) |
Details |
|
phosphatidylinositol 3 kinase (protein family or complex)
|
1(0,0,0,1) |
Details |
|
beta microseminoprotein
|
1(0,0,0,1) |
Details |
|
CN1
|
1(0,0,0,1) |
Details |
|
p34
|
1(0,0,0,1) |
Details |
|
protein its
|
1(0,0,0,1) |
Details |
|
TERP
|
1(0,0,0,1) |
Details |
|
serine threonine protein kinase
|
1(0,0,0,1) |
Details |
|
cyclin D1
|
1(0,0,0,1) |
Details |
|
macrophage colony stimulating factor
|
1(0,0,0,1) |
Details |
|
FSHbeta
|
1(0,0,0,1) |
Details |
|
Dnmt3L
|
1(0,0,0,1) |
Details |
|
Msp
|
1(0,0,0,1) |
Details |
|
transferase
|
1(0,0,0,1) |
Details |
|
lactate dehydrogenase (protein family or complex)
|
1(0,0,0,1) |
Details |
|
SRBC
|
1(0,0,0,1) |
Details |
|
glutathione reductase
|
1(0,0,0,1) |
Details |
|
cholinesterase
|
1(0,0,0,1) |
Details |
|
Hsp70
|
1(0,0,0,1) |
Details |
|
hemoglobin (protein family or complex)
|
1(0,0,0,1) |
Details |
|
per 1
|
1(0,0,0,1) |
Details |
|
progestins (protein family or complex)
|
1(0,0,0,1) |
Details |
|
CARB
|
1(0,0,0,1) |
Details |
|
ERK2
|
1(0,0,0,1) |
Details |
|
cAMP dependent protein kinase (protein family or complex)
|
1(0,0,0,1) |
Details |
|
p38
|
1(0,0,0,1) |
Details |
|
tyrosine hydroxylase
|
1(0,0,0,1) |
Details |
|
NFkappaB (protein family or complex)
|
1(0,0,0,1) |
Details |
|
protein is
|
1(0,0,0,1) |
Details |
|
granulocyte macrophage colony stimulating factor
|
1(0,0,0,1) |
Details |
|
Protein S
|
1(0,0,0,1) |
Details |
|
thioredoxin
|
1(0,0,0,1) |
Details |
|
keratin (protein family or complex)
|
1(0,0,0,1) |
Details |
|
erythropoietin
|
1(0,0,0,1) |
Details |
|
AR1
|
1(0,0,0,1) |
Details |
|
thyroid stimulating hormone (protein family or complex)
|
1(0,0,0,1) |
Details |
|
TLR4
|
1(0,0,0,1) |
Details |
|
chemokine
|
1(0,0,0,1) |
Details |
|
granulocyte colony stimulating factor
|
1(0,0,0,1) |
Details |
|
ASC1
|
1(0,0,0,1) |
Details |
|
tumor necrosis factor receptor (protein family or complex)
|
1(0,0,0,1) |
Details |
|
lysophospholipase
|
1(0,0,0,1) |
Details |
|
CSFR
|
1(0,0,0,1) |
Details |
|
Myomesin 2
|
1(0,0,0,1) |
Details |
|
hydrometrocolpos
|
1(0,0,0,1) |
Details |
|
PTEN
|
1(0,0,0,1) |
Details |
|
luteinizing hormone receptor
|
1(0,0,0,1) |
Details |
|
interleukin 8
|
1(0,0,0,1) |
Details |
|
CD18
|
1(0,0,0,1) |
Details |
|
beta globin
|
1(0,0,0,1) |
Details |
|
Dnmt3A
|
1(0,0,0,1) |
Details |
|
cyclin dependent protein kinase
|
1(0,0,0,1) |
Details |
|
diazepam binding inhibitor
|
1(0,0,0,1) |
Details |
|
calbindin
|
1(0,0,0,1) |
Details |
|
GnRH receptor
|
1(0,0,0,1) |
Details |
|
protein tyrosine phosphatase
|
1(0,0,0,1) |
Details |
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