sulfoxide

Identification (Source:EPA,EU)

ID 1808
Name sulfoxide
CAS 120-62-7
IUPAC
Inchi InChI=1S/C18H28O3S/c1-3-4-5-6-7-8-11-22(19)15(2)12-16-9-10-17-18(13-16)21-14-20-17/h9-10,13,15H,3-8,11-12,14H2,1-2H3
CIPAC
EPA Code
Formula C18H28O3S
SMILES [S@](C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])([C@]([H])(C([H])([H])[H])C([H])([H])c1c([H])c([H])c(c2c1[H])OC([H])([H])O2)=O
Status Not Available

Classification

Mode of Action
Pesticide Type
Chemical Group
Classification Synergists

Properties (Source:PubChem)

Molecular Weight 324.47812
Physical State
AlogP 4.887
H-Bond Donor 0
H-Bond Acceptor 3
Surface Area 326.91
Polar Surface Area 54.74

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

Related targets

Target Name RScore (About this table)
glutamine transaminase K 164(2,2,2,4) Details
methionine R sulfoxide reductases 166(1,3,3,26) Details
cis 2 116(1,2,2,6) Details
tumor necrosis factor alpha 103(1,1,1,23) Details
human ether a go go related gene 91(1,1,1,11) Details
Tyrosinase 90(1,1,1,10) Details
ATPases 89(1,1,1,9) Details
FMO1 88(1,1,1,8) Details
SBP1 86(1,1,1,6) Details
acylase 84(1,1,1,4) Details
glucagon 84(1,1,1,4) Details
serotonin 5 HT 2C receptor 82(1,1,1,2) Details
PCl 3 81(1,1,1,1) Details
Thymosin beta 4 134(0,4,4,14) Details
thioredoxin 91(0,2,2,31) Details
matrix metalloproteinase 2 72(0,2,3,7) Details
FMO3 67(0,2,2,7) Details
yl 1 64(0,2,2,4) Details
thymosin beta 10 63(0,2,2,3) Details
proton pump 62(0,2,2,2) Details
MSRA 135(0,1,2,100) Details
Ah receptor 69(0,1,1,39) Details
CYP3A 66(0,1,1,36) Details
superoxide dismutase 59(0,1,1,29) Details
cytochrome P450 (protein family or complex) 58(0,1,1,28) Details
carbonic anhydrase 48(0,1,1,18) Details
CYP3A5 41(0,1,1,11) Details
TCPT 38(0,1,1,8) Details
MP2 35(0,1,1,5) Details
CuL 2 35(0,1,1,5) Details
Pr 3 34(0,1,1,4) Details
CA4 33(0,1,1,3) Details
5 HT 2A 32(0,1,1,2) Details
aldehyde oxidase 32(0,1,1,2) Details
metallothionein (protein family or complex) 32(0,1,1,2) Details
oct 6 31(0,1,1,1) Details
PARP 1 31(0,1,1,1) Details
CT 1 31(0,1,1,1) Details
methionine sulfoxide reductase B 44(0,0,1,39) Details
mitogen activated protein kinase (protein family or complex) 41(0,0,0,41) Details
lipase 38(0,0,0,38) Details
CD34 37(0,0,0,37) Details
catalase 32(0,0,0,32) Details
vascular endothelial growth factor 31(0,0,0,31) Details
P19 27(0,0,0,27) Details
cytochrome c 26(0,0,0,26) Details
peroxisome proliferator activated receptor 26(0,0,0,26) Details
albumin 26(0,0,0,26) Details
apoA I 25(0,0,0,25) Details
PI3K 25(0,0,0,25) Details
p38 22(0,0,0,22) Details
PPAR delta 21(0,0,0,21) Details
caspase 3 20(0,0,0,20) Details
IL 1beta 19(0,0,0,19) Details
calmodulin 18(0,0,0,18) Details
myeloperoxidase 17(0,0,0,17) Details
PPAR gamma 17(0,0,0,17) Details
cytochrome P450 1A1 17(0,0,0,17) Details
alpha synuclein 17(0,0,0,17) Details
gelatinases 17(0,0,0,17) Details
Toll like receptor 4 16(0,0,0,16) Details
IL 6 16(0,0,0,16) Details
ATPase 15(0,0,0,15) Details
WAF1 15(0,0,0,15) Details
VEGFR 2 15(0,0,0,15) Details
gamma secretase (protein family or complex) 15(0,0,0,15) Details
calpain (protein family or complex) 14(0,0,0,14) Details
PCNA 13(0,0,0,13) Details
interleukin 4 13(0,0,0,13) Details
ADAMTS 13 13(0,0,0,13) Details
PdCl 2 13(0,0,0,13) Details
STAT5 13(0,0,0,13) Details
CD4 13(0,0,0,13) Details
transferase 12(0,0,0,12) Details
CXCL8 12(0,0,0,12) Details
CAPE 12(0,0,0,12) Details
alkaline phosphatase 12(0,0,0,12) Details
CYP2C19 11(0,0,1,6) Details
Notch1 11(0,0,0,11) Details
FRAP 11(0,0,0,11) Details
glutaredoxin 11(0,0,0,11) Details
complex is 10(0,0,0,10) Details
paraoxonase 1 10(0,0,0,10) Details
hES 10(0,0,0,10) Details
mitogen activated protein kinase phosphatase 3 10(0,0,0,10) Details
E5NT 10(0,0,0,10) Details
calcineurin (protein family or complex) 10(0,0,0,10) Details
estrogen receptor 9(0,0,0,9) Details
lactate dehydrogenase (protein family or complex) 9(0,0,0,9) Details
CYP2B6 9(0,0,0,9) Details
casein 9(0,0,0,9) Details
protein is 9(0,0,0,9) Details
SACS 9(0,0,1,4) Details
Myosin 9(0,0,0,9) Details
erythropoietin 9(0,0,0,9) Details
thioredoxin reductase 9(0,0,0,9) Details
cis 3 9(0,0,1,4) Details
Dax 1 9(0,0,0,9) Details
extracellular signal regulated kinase 1 9(0,0,0,9) Details
glutathione S transferase 8(0,0,0,8) Details
lysozyme 8(0,0,0,8) Details
glutathione reductase 8(0,0,0,8) Details
C18 8(0,0,1,3) Details
caspase (protein family or complex) 8(0,0,0,8) Details
histone deacetylase (protein family or complex) 8(0,0,0,8) Details
insulin like growth factor binding protein 4 8(0,0,0,8) Details
lecithin:cholesterol acyltransferase 8(0,0,0,8) Details
pim 1 8(0,0,0,8) Details
Death associated protein 5 8(0,0,0,8) Details
COX2 8(0,0,0,8) Details
CD62P 8(0,0,0,8) Details
cyclin L2 8(0,0,0,8) Details
Ki 67 8(0,0,0,8) Details
CYP1A2 7(0,0,0,7) Details
prion protein 7(0,0,0,7) Details
bcl 2 7(0,0,0,7) Details
glyceraldehyde 3 phosphate dehydrogenase 7(0,0,0,7) Details
RAGE 7(0,0,0,7) Details
mGluR4 7(0,0,0,7) Details
HDAC 7(0,0,0,7) Details
fatty acid synthase 7(0,0,0,7) Details
CD44 7(0,0,0,7) Details
G protein coupled receptors 7(0,0,0,7) Details
1 Cys 7(0,0,0,7) Details
5 HT 1A 7(0,0,0,7) Details
chloride channel (protein family or complex) 6(0,0,0,6) Details
INSL3 6(0,0,0,6) Details
glucose 6 phosphate dehydrogenase 6(0,0,0,6) Details
brains 6(0,0,0,6) Details
CREB 6(0,0,0,6) Details
glial cell line derived neurotrophic factor 6(0,0,0,6) Details
hemoglobin (protein family or complex) 6(0,0,0,6) Details
beta glucuronidase 6(0,0,0,6) Details
protein as 6(0,0,0,6) Details
beta catenin 6(0,0,0,6) Details
NHE1 6(0,0,0,6) Details
Cl 2 6(0,0,0,6) Details
c jun 6(0,0,0,6) Details
thrombin 6(0,0,0,6) Details
CD14 6(0,0,0,6) Details
phosphatidylinositol 3 kinase (protein family or complex) 6(0,0,0,6) Details
beta lactoglobulin 6(0,0,0,6) Details
annexin V 6(0,0,0,6) Details
androgen receptor 6(0,0,0,6) Details
DGAT 6(0,0,0,6) Details
TLR2 6(0,0,0,6) Details
factor A 6(0,0,0,6) Details
vasopressin V2 receptor 6(0,0,0,6) Details
LIPA 6(0,0,0,6) Details
ENTPD1 6(0,0,0,6) Details
NRSF 6(0,0,0,6) Details
orexin 1 receptors 6(0,0,0,6) Details
P450scc 6(0,0,0,6) Details
xanthine oxidase 5(0,0,0,5) Details
AR7 5(0,0,0,5) Details
protein kinase C (protein family or complex) 5(0,0,0,5) Details
adenylyl cyclase 5(0,0,0,5) Details
CB1 receptor 5(0,0,0,5) Details
CYP2E1 5(0,0,0,5) Details
glutathione transferase 5(0,0,0,5) Details
caspase 9 5(0,0,0,5) Details
CYP2C8 5(0,0,0,5) Details
angiotensin II 5(0,0,0,5) Details
ERK2 5(0,0,0,5) Details
caspase 1 5(0,0,0,5) Details
ICAM 1 5(0,0,0,5) Details
cholecystokinin 5(0,0,0,5) Details
alcohol dehydrogenase (protein family or complex) 5(0,0,0,5) Details
fibronectin 5(0,0,0,5) Details
CD8 5(0,0,0,5) Details
cytochrome b5 5(0,0,0,5) Details
bFGF 5(0,0,0,5) Details
glial fibrillary acidic protein 5(0,0,0,5) Details
IL 10 5(0,0,0,5) Details
beta glucosidase 5(0,0,0,5) Details
interleukin (protein family or complex) 5(0,0,0,5) Details
apolipoprotein 5(0,0,0,5) Details
Telomerase (protein family or complex) 5(0,0,0,5) Details
HER2 5(0,0,0,5) Details
Hepatocyte growth factor 5(0,0,0,5) Details
retinoid X receptor alpha 5(0,0,0,5) Details
survivin 5(0,0,0,5) Details
von Willebrand factor 5(0,0,0,5) Details
GATA 4 5(0,0,0,5) Details
CB2 5(0,0,0,5) Details
PLGF 5(0,0,0,5) Details
CYP1B1 5(0,0,0,5) Details
beta3Gn T8 5(0,0,0,5) Details
neuromedin U 5(0,0,0,5) Details
PPIA 5(0,0,0,5) Details
NMDA receptor (protein family or complex) 5(0,0,0,5) Details
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