General
Preferred name
PD158979
Synonyms
4-phenoxypiperidine ()
P&D ID
PD158979
CAS
3202-33-3
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)
PRICE 29
DESCRIPTION 4-phenoxypiperidines with muscle relaxant and anticonvulsant activities.
DESCRIPTION Displacement of [3H]mepyramine from human wild type N-terminal hemagglutinin-tagged histamine H1 receptor expressed in HEK293T cells after 4 hrs by microbeta liquid scintillation counting analysis (TargetMol Bioactive Compound Library)
Compound Sets
1
TargetMol Bioactive Compound Library
External IDs
13
Properties
(calculated by RDKit )
Molecular Weight
177.12
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
2
Ring Count
2
Aromatic Ring Count
1
cLogP
1.82
TPSA
21.26
Fraction CSP3
0.45
Chiral centers
0.0
Largest ring
6.0
QED
0.74
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data