Compound Detail
CHEMBL218991
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 | CHEMBL218991 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RGWXAJBCIUVZRO-JEJOPICUSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
318.9
MW (Da)
3.44
ALogP
2
HBA
0
HBD
23.6
PSA (Ų)
0.79
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.95
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL264 | Ki | 7.95 | 7.95 | 11.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | Ki | = | 11.2 | nM | 7.95 | Binding affinity at histamine H3 receptor by hH3-[35S]GTPgamma[S] binding assay | 16908150 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16908150 | 10.1016/j.bmcl.2006.07.093 | Histamine H3 receptor | 1 |
| 16908150 | 10.1016/j.bmcl.2006.07.093 | Voltage-gated inwardly rectifying potassium channel KCNH2 | 1 |
Data from ChEMBL 36 via Core Engine