Compound Detail
CHEMBL359741
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NC(Cc1c[nH]c2ccccc12)Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2c(F)cccc2F)c1=O
Basic Information
| ChEMBL ID | CHEMBL359741 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GQYRIEWGMRMRQK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
539.5
MW (Da)
2.82
ALogP
7
HBA
2
HBD
107.8
PSA (Ų)
0.31
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Gonadotropin-releasing hormone receptor CHEMBL1855 | Ki | 6.42 | 6.42 | 380.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Gonadotropin-releasing hormone receptor | Ki | = | 380.0 | nM | 6.42 | Inhibitory constant against cloned human Gonadotropin-releasing hormone receptor... | 15664839 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15664839 | 10.1016/j.bmcl.2004.11.026 | Gonadotropin-releasing hormone receptor | 1 |
Data from ChEMBL 36 via Core Engine