General
Preferred name
PULEGONE
Synonyms
(+)-Pulegone ()
(R)-(+)-Pulegone ()
P&D ID
PD085564
CAS
89-82-7
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Pulegone is a monoterpene ketone compound widely present in the essential oils of many plants. Pulegone can also be used as a bird repellent. Pulegone has multiple activities such as anti-inflammatory, antibacterial, antifungal, and anti-hyperalgesic effects. Pulegone is particularly effective against bacteria of the Salmonella species[1][2][3][4][5].
PRICE 29
DESCRIPTION 1. Pulegone ((+)-Pulegone) has cytotoxicity followed by regenerative cell proliferation is the MOA for Pulegone-induced urothelial tumors in female rats. 2. Pulegone induces a verapamil-sensitive psychostimulant effect that appears to independ on the opening of L-type calcium channels. 3. Pulegone has negative reinforcing properties and seems to possess anxiolytic-like actions unrelated to the benzodiazepine site of the ??-aminobutyric acid type A (GABAA) receptor.
DESCRIPTION 1. Pulegone ((+)-Pulegone) has cytotoxicity followed by regenerative cell proliferation is the MOA for Pulegone-induced urothelial tumors in female rats. 2. Pulegone induces a verapamil-sensitive psychostimulant effect that appears to independ on the opening of L-type calcium channels. 3. Pulegone has negative reinforcing properties and seems to possess anxiolytic-like actions unrelated to the benzodiazepine site of the γ-aminobutyric acid type A (GABAA) receptor. (TargetMol Bioactive Compound Library)
Compound Sets
4
Cayman Chemical Bioactives
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
29
Properties
(calculated by RDKit )
Molecular Weight
152.12
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
0
Rotatable Bonds
0
Ring Count
1
Aromatic Ring Count
0
cLogP
2.71
TPSA
17.07
Fraction CSP3
0.7
Chiral centers
1.0
Largest ring
6.0
QED
0.49
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
L-type calcium channel
TRP Channel
Bacterial
COX
Fungal
Heme Oxygenase (HO)
JNK
Keap1-Nrf2
NF-κB
NO Synthase
p38 MAPK
PERK
MOA
Calcium Channel
Pathway
Membrane Transporter/Ion Channel
Metabolism
Anti-infection
Cell Cycle/DNA Damage
Immunology/Inflammation
MAPK/ERK Pathway
Metabolic Enzyme/Protease
Neuronal Signaling
NF-¦ÊB
Source data