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

CHEMBL1950583

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
CCCCCC(O)CC(=O)CCc1ccc2c(c1)OCO2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1950583
Phase Preclinical
Structure Type MOL
InChI Key NPZZCENHZLRAHT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

292.4
MW (Da)
3.25
ALogP
4
HBA
1
HBD
55.8
PSA (Ų)
0.71
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H24O4
MW 292.38
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness 1.21

Literature References

PubMed DOI Target Context # Activities
22257892 10.1016/j.bmcl.2011.12.113 Transient receptor potential cation channel subfamily A member 1 3
22257892 10.1016/j.bmcl.2011.12.113 Transient receptor potential cation channel subfamily V member 1 3

Data from ChEMBL 36 via Core Engine