General
Preferred name
DOCOSAPENTAENOIC ACID
Synonyms
Docosapentaenoic acid (22n-3) ()
Docosapentaenoic Acid-d5 ()
Docosapentaenoic Acid (sodium salt) ()
P&D ID
PD020552
CAS
24880-45-3
244880-45-3
1215168-70-9
Tags
drug candidate
natural product
available
Drug indication
Discovery agent
Drug Status
investigational
Max Phase
Phase 2
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
4
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
35
Properties
(calculated by RDKit )
Molecular Weight
330.26
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
15
Ring Count
0
Aromatic Ring Count
0
cLogP
6.77
TPSA
37.3
Fraction CSP3
0.5
Chiral centers
0.0
Largest ring
0.0
QED
0.27
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Endogenous Metabolite
Source data
