General
Preferred name
NICOMORPHINE
Synonyms
Morphine dinicotinate (ester) ()
Dea no. 9312 ()
Nicomorfina ()
Morphine dinicotinate ester ()
Morphine dinicotinate ()
IDS-NN-003 ()
3,6-dinicotinoylmorphine ()
P&D ID
PD072387
CAS
639-48-5
Tags
drug
Drug Status
approved
experimental
investigational
Max Phase
2.0
Drug indication
Pain
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 ]]
Compound Sets
4
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
18
Properties
(calculated by RDKit )
Molecular Weight
495.18
Hydrogen Bond Acceptors
8
Hydrogen Bond Donors
0
Rotatable Bonds
4
Ring Count
7
Aromatic Ring Count
3
cLogP
3.37
TPSA
90.85
Fraction CSP3
0.31
Chiral centers
5.0
Largest ring
6.0
QED
0.31
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
