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

CHEMBL318034

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
CN(C(=O)C1C(c2ccccc2)=C1c1ccc(Cl)cc1)[C@H]1CCCC[C@@H]1N1CCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL318034
Phase Preclinical
Structure Type MOL
InChI Key QCGGFEVPGFMZTQ-XAWUTYGVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

435.0
MW (Da)
5.75
ALogP
2
HBA
0
HBD
23.6
PSA (Ų)
0.60
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H31ClN2O
MW 435.01
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -0.27

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(96)00615-4 Kappa-type opioid receptor 1

Data from ChEMBL 36 via Core Engine