Compound Detail
CHEMBL360953
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 | CHEMBL360953 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SGFIBQBVOOVDSS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
268.4
MW (Da)
1.96
ALogP
4
HBA
1
HBD
34.8
PSA (Ų)
0.79
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H1 receptor CHEMBL231 | Ki | 7.66 | 7.66 | 22.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H1 receptor | Ki | = | 22.0 | nM | 7.66 | Binding affinity for H1 histamine receptor expressed in CHO cells | 15771458 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15771458 | 10.1021/jm049495j | Rattus norvegicus | 7 |
| 15771458 | 10.1021/jm049495j | No relevant target | 5 |
| 15771458 | 10.1021/jm049495j | Cavia porcellus | 5 |
| 15771458 | 10.1021/jm049495j | Canis familiaris | 3 |
| 15771458 | 10.1021/jm049495j | Histamine H1 receptor | 1 |
Data from ChEMBL 36 via Core Engine