General
Preferred name
Pseudothymine
Synonyms
6-Methyluracil ()
P&D ID
PD158447
CAS
15985-99-6
626-48-2
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 6-Methyluracil (Pseudothymine), a metabolite of Uracil, can be used as an indicator of acetoacetyl-CoA (AACoA) accumulation. 6-Methyluracil exhibits antiradiation effect in vivo[1][2].
DESCRIPTION 6-Methyluracil is an inhibitor of acetylcholinesterase and butyrylcholinesterase. (Enamine Bioactive Compounds)
Compound Sets
3
Enamine Bioactive Compounds
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
External IDs
34
Properties
(calculated by RDKit )
Molecular Weight
126.04
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
0
Ring Count
1
Aromatic Ring Count
1
cLogP
-0.63
TPSA
65.72
Fraction CSP3
0.2
Chiral centers
0.0
Largest ring
6.0
QED
0.49
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
Pathway
Metabolic Enzyme/Protease
Source data