General
Preferred name
PD043782
Synonyms
4-methoxy-.alpha.-Pyrrolidinopropiophenone (tosylate) ()
4-methoxy-.alpha.-Pyrrolidinopropiophenone (hydrochloride) ()
P&D ID
PD043782
CAS
2748561-60-4
1794760-01-2
Tags
available
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
18
Properties
(calculated by RDKit )
Molecular Weight
233.14
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
0
Rotatable Bonds
4
Ring Count
2
Aromatic Ring Count
1
cLogP
2.36
TPSA
29.54
Fraction CSP3
0.5
Chiral centers
1.0
Largest ring
6.0
QED
0.75
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
