Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL188565

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCCc1c[nH]c([C@@H]2Cc3ccccc3N2C(=O)[C@@H](N)CC)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL188565
Phase Preclinical
Structure Type MOL
InChI Key AMQJNDVOPACRBM-HOCLYGCPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

312.4
MW (Da)
2.73
ALogP
3
HBA
2
HBD
75.0
PSA (Ų)
0.89
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H24N4O
MW 312.42
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.48

Literature References

PubMed DOI Target Context # Activities
15456245 10.1021/jm030548r Delta-type opioid receptor 2
15456245 10.1021/jm030548r Mu-type opioid receptor 2

Data from ChEMBL 36 via Core Engine