Compound Detail
CHEMBL4283085
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 | CHEMBL4283085 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CJBSFABNTFBYMW-HNNXBMFYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
295.4
MW (Da)
3.32
ALogP
3
HBA
1
HBD
63.2
PSA (Ų)
0.47
QED
0
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.83
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Transcriptional activator protein LasR CHEMBL1075207 | EC50 | 7.83 | 7.83 | 14.9 | 1 |
| PhzR CHEMBL1075213 | EC50 | 6.08 | 6.08 | 834.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Transcriptional activator protein LasR | EC50 | = | 14.91 | nM | 7.83 | Agonist activity at Pseudomonas aeruginosa LasR expressed in Escherichia coli JL... | 29793752 |
| PhzR | EC50 | = | 834.1 | nM | 6.08 | Agonist activity at Pseudomonas aeruginosa QscR expressed in Escherichia coli JL... | 29793752 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29793752 | 10.1016/j.bmc.2018.05.018 | PhzR | 2 |
| 29793752 | 10.1016/j.bmc.2018.05.018 | Transcriptional activator protein LasR | 2 |
Data from ChEMBL 36 via Core Engine