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

CHEMBL4740343

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
COc1cc2c(c(OC)c1OC)CN(CCCC(=O)c1c(C)c(OC)c(OC)c(OC)c1OC)CC2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4740343
Phase Preclinical
Structure Type MOL
InChI Key YZWVGOGOHXUOIS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

503.6
MW (Da)
4.08
ALogP
9
HBA
0
HBD
84.9
PSA (Ų)
0.40
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H37NO8
MW 503.59
Aromatic Rings 2
Heavy Atoms 36
NP-Likeness 0.33

Literature References

PubMed DOI Target Context # Activities
33049607 10.1016/j.ejmech.2020.112906 Sigma intracellular receptor 2 1
33049607 10.1016/j.ejmech.2020.112906 Sigma non-opioid intracellular receptor 1 1

Data from ChEMBL 36 via Core Engine