General
Preferred name
THYMOL
Synonyms
Phenol, 5-methyl-2-(1-methylethyl)- ()
2-Isopropyl-5-Methylphenol ()
Pseudoaspidin ()
Thymic Acid ()
Thyme Camphor ()
2-isopropyl-5-methylphenol, IPMP ()
Thymolum ()
Tellodont ()
NSC-11215 ()
3-hydroxy-p-cymene ()
NSC-47821 ()
NSC-49142 ()
Sotol ()
P-cymen-3-ol ()
Eftab ()
Gppe Mthwsh Tab ()
Valda ()
FEMA NO. 3066 ()
Listerine ()
Tellora ()
Apiguard ()
P&D ID
PD009428
CAS
89-83-8
Tags
available
drug
natural product
Approved by
FDA
Drug Status
approved
investigational
Max Phase
2.0
Drug indication
Gingivitis
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 Thymol is a terpenoid compound found in oils extracted from herbal plants such as oregano and thyme. (GtoPdb)
DESCRIPTION Thymol is a TRPA1 agonist. Thymol induces cancer cell apoptosis. Thymol is the main monoterpene phenol occurring in essential oils isolated from plants belonging to the Lamiaceae family, and other plants such as those belonging to the Verbenaceae, Scrophulariaceae, Ranunculaceae and Apiaceae families. Thymol has antioxidant, anti-inflammatory, antibacterial and antifungal effects[1].
PRICE 29
DESCRIPTION Thymol is the main monoterpene phenol obtained from thyme oil or other volatile oils. It is used as a stabilizer in pharmaceutic preparations. It has been used for its antiseptic, antibacterial, and antifungal actions, and was formerly used as a vermifuge. (Enamine Bioactive Compounds)
DESCRIPTION Thymol, also known as Pseudoaspidin, is a principal monoterpene phenol found in the essential oils of plants from the Lamiaceae family, along with several other families including Verbenaceae, Scrophulariaceae, Ranunculaceae, and Apiaceae. This compound exhibits antioxidant, anti-inflammatory, antibacterial, and antifungal properties. (TargetMol Bioactive Compound Library)
Compound Sets
19
Cayman Chemical Bioactives
34496
ChEMBL Drugs
CHEMBL29411
Concise Guide to Pharmacology 2017/18
2499
Concise Guide to Pharmacology 2019/20
2499
Concise Guide to Pharmacology 2021/22
2499
Concise Guide to Pharmacology 2023/24
2499
Drug Repurposing Hub
DrugBank
DB02513
DrugBank Approved Drugs
DB02513
DrugCentral
4258
DrugCentral Approved Drugs
4258
DrugMatrix
Enamine Bioactive Compounds
EBC-12254
Enamine BioReference Compounds
Guide to Pharmacology
2499
MedChem Express Bioactive Compound Library
HY-N6810
NPC Screening Collection
Selleckchem Bioactive Compound Library
thymol
TargetMol Bioactive Compound Library
T3S0717
External IDs
39
Properties
(calculated by RDKit )
Molecular Weight
150.1
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
2.82
TPSA
20.23
Fraction CSP3
0.4
Chiral centers
0.0
Largest ring
6.0
QED
0.65
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Antibacterial
Bacterial
TRPA1
Apoptosis
Fungal
Immunology & Inflammation related
Indication
ringworm, antiseptic
MOA
GABA receptor positive allosteric modulator
Pathway
Microbiology/virology
Anti-infection
Source data