General
Preferred name
Arachidonyltrifluoromethane
Synonyms
AA-COCF3 ()
ARACHIDONYL TRIFLUOROMETHYLKETONE ()
AACOCF ()
Arachidonyl trifluoromethyl ketone ()
arachidonyl trifluoromethyl ketone ()
AACOCF3 ()
P&D ID
PD003553
CAS
149301-79-1
Tags
drug candidate
available
Drug indication
Discovery agent
Drug Status
investigational
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 110
DESCRIPTION AACOCF3 (Arachidonyl trifluoromethyl ketone) is a cell-permeable trifluoromethyl ketone analog of arachidonic acid and a potent, selective slow binding inhibitor of the 85-kDa cytosolic phospholipase A2 (cPLA2). By blocking the production of arachidonate and 12-hydroxyeicosatetraenoic acid in calcium ionophore-challenged platelets, AACOCF3 hinders their synthesis. Additionally, AACOCF3 inhibits glucose-induced insulin secretion from isolated rat islets, making it promising for cardiovascular disease research.
DESCRIPTION inhibitor of cytosolic phospholipase A2; inhibitor of fatty acid amide hydrolase (Informer Set)
DESCRIPTION AACOCF, an anlogue of arachidonic acid, is a slow-binding inhibitor of cytosolic (85 kDa) phospholipase A2. It also inhibits fatty acid amide hydrolase (FAAH, anandamide amidase) in vitro. (BOC Sciences Bioactive Compounds)
Cell lines
2
Organisms
0
Compound Sets
9
BOC Sciences Bioactive Compounds
aacocf-cas-149301-79-1-item-50226
Cayman Chemical Bioactives
62120
CZ-OPENSCREEN Bioactive Library
DrugBank
DB17022
DrugMAP
DMHL48F
Guide to Pharmacology
5142
Informer Set
411724
Mcule NIBR MoA Box Subset
MCULE-3853113361
Novartis Chemogenetic Library (NIBR MoA Box)
External IDs
28
Properties
(calculated by RDKit )
Molecular Weight
356.23
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
0
Rotatable Bonds
14
Ring Count
0
Aromatic Ring Count
0
cLogP
7.26
TPSA
17.07
Fraction CSP3
0.57
Chiral centers
0.0
Largest ring
0.0
QED
0.24
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
FAAH
PLA2G4A
PLA2G4B
PLA2G4C
PLA2G4D
Compound status
probe
Member status
virtual
MOA
Cytosolic Phospholipase A2 (cPLA2) Inhibitors
Source data