Compound Detail
CHEMBL3354888
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
Basic Information
| ChEMBL ID | CHEMBL3354888 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MNOZOZKWRANORG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
428.5
MW (Da)
5.29
ALogP
4
HBA
0
HBD
43.7
PSA (Ų)
0.38
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 5.72 | 5.72 | 1910.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 1910.0 | nM | 5.72 | Inhibition of P-glycoprotein (unknown origin) expressed in MDCK cells assessed a... | 25462269 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25462269 | 10.1016/j.ejmech.2014.10.082 | Unchecked | 3 |
| 25462269 | 10.1016/j.ejmech.2014.10.082 | Sigma non-opioid intracellular receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine