General
Preferred name
TROPOLONE
Synonyms
2-Hydroxytropone, Purpurocatechol ()
Tropolone (NSC 89303) ()
Tropolon ()
P&D ID
PD011923
CAS
533-75-5
Tags
available
drug candidate
Drug indication
Discovery agent
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 Tropolone is a seven-membered non-benzenoid aromatic compound, which is the precursor of many Azulene derivatives. Tropolone is a potent mushroom tyrosinase inhibitor with an IC50 value of 0.4 ¦ÌM. Its inhibitory effect can be achieved by dialysis or excess CU2+ Reversa. Tropolone exhibits broad anti-viral and anti-fungal activity and is synergistic upon co-treatment with nucleos(t)ide analog drugs. Tropolone is a promising candidate for research in osteosarcoma[1][2][3][4].
PRICE 29
DESCRIPTION Tropolon is a tyrosinase inhibitor. (Enamine Bioactive Compounds)
DESCRIPTION Tropolone, a metal chelator, possesses weak antioxidative and radical-scavenging properties and shows a strong affinity for ferric ion (TargetMol Bioactive Compound Library)
Compound Sets
9
Cayman Chemical Bioactives
29674
DrugMAP
DMOMXP7
DrugMatrix
Enamine Bioactive Compounds
EBC-03102
EU-OPENSCREEN Bioactive Compound Library
EOS102001
MedChem Express Bioactive Compound Library
HY-N7135
NIH Mechanistic Set
Selleckchem Bioactive Compound Library
tropolone
TargetMol Bioactive Compound Library
T8087
External IDs
32
Properties
(calculated by RDKit )
Molecular Weight
122.04
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
0
Ring Count
1
Aromatic Ring Count
1
cLogP
0.75
TPSA
37.3
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
7.0
QED
0.55
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Tyrosinase
Fungal
Pathway
Anti-infection
Metabolic Enzyme/Protease
Proteases/Proteasome
Source data