General
Preferred name
PERFLUOROOCTANOIC ACID
Synonyms
ammonium-perfluorocaprylate ()
Ammonium pentadecafluorooctanoate ()
Pentadecafluorooctanoic Acid ()
P&D ID
PD053508
CAS
335-67-1
Tags
natural product
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
6
Cayman Chemical Bioactives
Drug Repurposing Hub
Enamine BioReference Compounds
NURSA ligand set
Other bioactive compounds
ReFrame library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
27
Properties
(calculated by RDKit )
Molecular Weight
413.97
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
6
Ring Count
0
Aromatic Ring Count
0
cLogP
4.45
TPSA
37.3
Fraction CSP3
0.88
Chiral centers
0.0
Largest ring
0.0
QED
0.65
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Pim1
MOA
PIM kinase inhibitor
Source data
