Compound Detail
CHEMBL112503
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Basic Information
| ChEMBL ID | CHEMBL112503 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RUWLKRMCVYYUQQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
247.3
MW (Da)
1.76
ALogP
5
HBA
2
HBD
96.7
PSA (Ų)
0.46
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL4124 | Ki | 6.77 | 6.77 | 170.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | Ki | = | 170.0 | nM | 6.77 | In vitro antagonism of the histamine H3-receptor in the rat cerebral cortex. | 7650687 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7650687 | 10.1021/jm00017a018 | Histamine H3 receptor | 1 |
Data from ChEMBL 36 via Core Engine