General
Preferred name
PD005774
Synonyms
(9Z,11E,13S)-13-hydroxyoctadeca-9,11-dienoic acid ()
13(S)-HODE ()
13(S)-HODE-d4 ()
P&D ID
PD005774
CAS
10219-69-9
29623-28-7
5204-88-6
139408-39-2
Tags
drug candidate
natural product
available
Drug indication
Discovery agent
Drug Status
experimental
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 ]]
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
35
Properties
(calculated by RDKit )
Molecular Weight
296.24
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
14
Ring Count
0
Aromatic Ring Count
0
cLogP
4.86
TPSA
57.53
Fraction CSP3
0.72
Chiral centers
1.0
Largest ring
0.0
QED
0.36
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
