General
Preferred name
PD165848
Synonyms
9(E),12(E)-Linoleic Acid ethyl ester ()
P&D ID
PD165848
CAS
544-35-4
6114-21-2
Tags
available
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 ]]
Compound Sets
1
Cayman Chemical Bioactives
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
10
Properties
(calculated by RDKit )
Molecular Weight
308.27
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
15
Ring Count
0
Aromatic Ring Count
0
cLogP
6.36
TPSA
26.3
Fraction CSP3
0.75
Chiral centers
0.0
Largest ring
0.0
QED
0.2
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
