Compound Detail
CHEMBL1433079
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 | CHEMBL1433079 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UWUDCQQAISVQOP-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
357.5
MW (Da)
3.80
ALogP
5
HBA
0
HBD
36.4
PSA (Ų)
0.72
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.71
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL264 | Ki | 7.71 | 7.505 | 19.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | Ki | = | 19.5 | nM | 7.71 | Binding affinity in Nluc-hH3R assessed in HEK293 cells by NanoBRET binding assay | 34309390 |
| Histamine H3 receptor | Ki | = | 50.12 | nM | 7.3 | Binding affinity in Nluc-hH3R assessed in HEK293T cells by NanoBRET binding assa... | 34309390 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34309390 | 10.1021/acs.jmedchem.1c01089 | Histamine H3 receptor | 2 |
Data from ChEMBL 36 via Core Engine