General
Preferred name
Isotonitazene
Synonyms
Isotonitazene-d7 ()
Isotonitazene (CRM) ()
Isotonitazene-d7 (CRM) ()
Isotonitazene (citrate) ()
P&D ID
PD117306
CAS
14188-81-9
3053113-17-7
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()] ]]
Description
(extracted from source data)
DESCRIPTION
Isotonitazene is an example of the class of 2-benzylbenzimidazole ('nitazene') non-fentanyl novel synthetic opioids (NSOs) . It acts as a full-efficacy μ opioid receptor (MOR) agonist in vitro.
(GtoPdb)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
2
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
5
Molecular Weight
410.23
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
0
Rotatable Bonds
10
Ring Count
3
Aromatic Ring Count
3
cLogP
4.66
TPSA
73.43
Fraction CSP3
0.43
Chiral centers
0.0
Largest ring
6.0
QED
0.36
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
