General
Preferred name
NALTRIBEN
Synonyms
[3H]naltriben ()
NALTRIBEN METHANESULFONATE ()
Naltriben (mesylate) ()
P&D ID
PD048467
CAS
111555-58-9
122517-78-6
Tags
drug candidate
natural product
available
Drug indication
Discovery agent
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 ]]
Cell lines
0
Organisms
1
Compound Sets
8
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
27
Properties
(calculated by RDKit )
Molecular Weight
415.18
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
2
Rotatable Bonds
2
Ring Count
8
Aromatic Ring Count
3
cLogP
3.84
TPSA
66.07
Fraction CSP3
0.46
Chiral centers
4.0
Largest ring
6.0
QED
0.67
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
OPRD1, OPRK1, OPRM1
MOA
Opioid Receptor antagonist
Source data
