General
Preferred name
δ-Valerolactam
Synonyms
2-Piperidone ()
¦Ä-Valerolactam ()
P&D ID
PD158381
CAS
675-20-7
27154-43-4
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 2-Piperidone is an endogenous metabolite. 2-Piperidone is the biomarker for the activity of CYP2E1[1].
Compound Sets
1
MedChem Express Bioactive Compound Library
External IDs
25
Properties
(calculated by RDKit )
Molecular Weight
99.07
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
0
Ring Count
1
Aromatic Ring Count
0
cLogP
0.29
TPSA
29.1
Fraction CSP3
0.8
Chiral centers
0.0
Largest ring
6.0
QED
0.46
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
Pathway
Metabolic Enzyme/Protease
Source data