General
Preferred name
Hydroxytyrosol
Synonyms
3-Hydroxytyrosol ()
3,4-Dihydroxyphenylethanol ()
Dihydroxyphenylethanol ()
2-(3,4-Di-hydroxyphenyl)-ethanol ()
DOPET ()
3,4-Dihydroxyphenethyl alcohol ()
3,4-Dihydroxyphenyl ethanol ()
P&D ID
PD020833
CAS
10597-60-1
Tags
drug candidate
natural product
available
Drug Status
investigational
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
1
Organisms
0
Compound Sets
6
Cayman Chemical Bioactives
DrugBank
MedChem Express Bioactive Compound Library
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
30
Properties
(calculated by RDKit )
Molecular Weight
154.06
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
3
Rotatable Bonds
2
Ring Count
1
Aromatic Ring Count
1
cLogP
0.63
TPSA
60.69
Fraction CSP3
0.25
Chiral centers
0.0
Largest ring
6.0
QED
0.55
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Anti-infection
Metabolic Enzyme/Protease
Target
Bacterial
Endogenous Metabolite
Fungal
Source data
