General
Preferred name
TROPOLONE
Synonyms
Tropolone (NSC 89303) ()
2-Hydroxytropone, Purpurocatechol ()
P&D ID
PD011923
CAS
533-75-5
Tags
drug candidate
natural product
available
Drug indication
Discovery agent
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
8
Cayman Chemical Bioactives
29674
DrugMAP
DMOMXP7
DrugMatrix
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
30
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)
Pathway
Proteases/Proteasome
Metabolic Enzyme/Protease
Target
Tyrosinase
Source data