General
Preferred name
Piceol
Synonyms
4-Acetylphenol ()
4'-Hydroxyacetophenone ()
p-Acetylphenol ()
4-HYDROXYACETOPHENONE ()
P-hydroxyacetophenone ()
1-(4-Hydroxyphenyl)Ethanone ()
Para-Hydroxyacetophenone ()
P&D ID
PD065279
CAS
99-93-4
Tags
natural product
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Cell lines
0
Organisms
5
Compound Sets
3
Cayman Chemical Bioactives
MedChem Express Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
32
Properties
(calculated by RDKit )
Molecular Weight
136.05
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
1.59
TPSA
37.3
Fraction CSP3
0.12
Chiral centers
0.0
Largest ring
6.0
QED
0.6
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Pathway
Metabolism
Anti-infection
Target
Xanthine oxidase
HBV
Source data