Compound Detail
CHEMBL541720
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
CCCCCCCCCC(=O)O[C@@]12[C@H](O)[C@@H](C)[C@@]3(O)[C@@H](C=C(CO)C[C@@]4(O)C(=O)C(C)=C[C@@H]34)[C@@H]1C2(C)C
Basic Information
| ChEMBL ID | CHEMBL541720 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YJFFPVQHOKPCRV-JQRZRIHSSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
518.7
MW (Da)
3.62
ALogP
7
HBA
4
HBD
124.3
PSA (Ų)
0.20
QED
1
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily V member 4 CHEMBL6126 | EC50 | 6.35 | 6.35 | 450.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily V member 4 | EC50 | = | 450.0 | nM | 6.35 | Activation of mouse wild type TRPV4 expressed in HEK293 cells assessed as increa... | 19361196 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19361196 | 10.1021/jm9001007 | Transient receptor potential cation channel subfamily V member 4 | 1 |
| 19361196 | 10.1021/jm9001007 | HEK293 | 1 |
Data from ChEMBL 36 via Core Engine