Compound Detail
CHEMBL392709
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
CN[C@@H](Cn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)cc1)C2)c1ccccc1
Basic Information
| ChEMBL ID | CHEMBL392709 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JLFBHKWEJXWJSJ-MHZLTWQESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
551.0
MW (Da)
4.51
ALogP
6
HBA
1
HBD
59.3
PSA (Ų)
0.35
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Gonadotropin-releasing hormone receptor CHEMBL1855 | Ki | 7.35 | 7.35 | 45.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Gonadotropin-releasing hormone receptor | Ki | = | 45.0 | nM | 7.35 | Displacement of [125I]His5,D-Tyr6]GnRH from human cloned GnRH receptor transfect... | 17561404 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17561404 | 10.1016/j.bmc.2007.05.029 | Gonadotropin-releasing hormone receptor | 1 |
Data from ChEMBL 36 via Core Engine