General
Preferred name
Diallyl Disulfide
Synonyms
GARLICIN ()
DIALLYLDISULFIDE ()
P&D ID
PD000580
CAS
73807-55-3
2179-57-9
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Diallyl disulfide, an active compound in garlic oil, is an orally active human squalene monooxygenase inhibitor with an IC50 of 400 ¦ÌM for squalene epoxidation. Diallyl disulfide exhibits obvious anti-inflammatory, anti-oxidative, antidepressant and anti-tumor activities[1][2][3][4].
PRICE 450
DESCRIPTION Diallyl disulfide has antitumor effect, the effect can be enhanced by miR-200b and miR-22. (TargetMol Bioactive Compound Library)
Cell lines
5
Organisms
0
Compound Sets
4
Cayman Chemical Bioactives
10012582
MedChem Express Bioactive Compound Library
HY-W015635
Selleckchem Bioactive Compound Library
diallyl-disulfide
TargetMol Bioactive Compound Library
TN1576
External IDs
29
Properties
(calculated by RDKit )
Molecular Weight
146.02
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
5
Ring Count
0
Aromatic Ring Count
0
cLogP
2.74
TPSA
0.0
Fraction CSP3
0.33
Chiral centers
0.0
Largest ring
0.0
QED
0.33
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
IL Receptor
NF-κB
NOS
NF-¦ÊB
Pathway
Immunology/Inflammation
Source data