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Compound Detail

CHEMBL255467

MORPHINONE
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CN1CC[C@]23c4c5ccc(O)c4O[C@H]2C(=O)C=C[C@H]3[C@H]1C5

Basic Information

ChEMBL ID CHEMBL255467
Name MORPHINONE
Phase Preclinical
Structure Type MOL
InChI Key PFBSOANQDDTNGJ-YNHQPCIGSA-N
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

283.3
MW (Da)
1.41
ALogP
4
HBA
1
HBD
49.8
PSA (Ų)
0.78
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C17H17NO3
MW 283.33
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness 2.40

Activity Summary

EC50 1 meas. best 7.55
Ki 1 meas. best 6.84

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Mu-type opioid receptor
CHEMBL233
EC50 7.55 7.55 28.0 1
Mu-type opioid receptor
CHEMBL233
Ki 6.84 6.84 146.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
17616524 10.1074/jbc.m703272200 Mu-type opioid receptor 3

Data from ChEMBL 36 via Core Engine