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

CHEMBL535803

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)COc1c(Cl)cc(Cl)cc1Cl)[C@@H]1CCCC[C@H]1N1CCCC1.Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL535803
Phase Preclinical
Structure Type MOL
InChI Key SEJUYAVHLWXDPS-GBNZRNLASA-N
Parent Compound CHEMBL1188239
Active Moiety CHEMBL1188239
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

419.8
MW (Da)
4.89
ALogP
3
HBA
0
HBD
32.8
PSA (Ų)
0.68
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 C19H26Cl4N2O2
MW 456.24
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -0.73

Literature References

PubMed DOI Target Context # Activities
2832603 10.1021/jm00399a025 Kappa-type opioid receptor 1
2832603 10.1021/jm00399a025 Mu-type opioid receptor 1

Data from ChEMBL 36 via Core Engine