Compound Detail
CHEMBL181945
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Basic Information
| ChEMBL ID | CHEMBL181945 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ROPGIFWSWMTPPO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
494.0
MW (Da)
4.86
ALogP
6
HBA
1
HBD
70.0
PSA (Ų)
0.40
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.03
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Gonadotropin-releasing hormone receptor CHEMBL1855 | Ki | 7.03 | 7.03 | 93.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Gonadotropin-releasing hormone receptor | Ki | = | 93.0 | nM | 7.03 | Binding affinity was determined against human gonadotropin-releasing hormone rec... | 15713397 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15713397 | 10.1016/j.bmcl.2005.01.009 | Gonadotropin-releasing hormone receptor | 1 |
Data from ChEMBL 36 via Core Engine