Compound Detail
CHEMBL5276441
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Basic Information
| ChEMBL ID | CHEMBL5276441 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CZAOGQZBUXBQHJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
415.6
MW (Da)
4.11
ALogP
8
HBA
2
HBD
79.4
PSA (Ų)
0.40
QED
0
Ro5 Violations
13
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H2 receptor CHEMBL1941 | Ki | 8.7 | 8.7 | 2.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H2 receptor | Ki | = | 2.0 | nM | 8.7 | Antagonist activity at histamine H2 receptor (unknown origin) assessed as inhibi... | 33569941 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33569941 | 10.1021/acs.jmedchem.0c01901 | Histamine H2 receptor | 1 |
Data from ChEMBL 36 via Core Engine