General
Preferred name
Valeryl fentanyl
Synonyms
Valeryl fentanyl (hydrochloride) ()
Valeryl fentanyl-d5 (hydrochloride) ()
Valeryl fentanyl-d5 ()
Valeryl fentanyl (CRM) ()
Valeryl fentanyl-d5 (CRM) ()
Valeryl fentanyl-13C6 ()
2,3-Benzodioxole fentanyl ()
P&D ID
PD044160
CAS
117332-91-9
2747917-71-9
122882-90-0
2747915-99-5
2748625-09-2
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
16
Properties
(calculated by RDKit )
Molecular Weight
364.25
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
8
Ring Count
3
Aromatic Ring Count
2
cLogP
4.92
TPSA
23.55
Fraction CSP3
0.46
Chiral centers
0.0
Largest ring
6.0
QED
0.66
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
