Compound Detail
CHEMBL128190
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Basic Information
| ChEMBL ID | CHEMBL128190 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BNIODALAVHNQQG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
331.5
MW (Da)
2.69
ALogP
4
HBA
0
HBD
18.9
PSA (Ų)
0.72
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.87
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL264 | Ki | 7.87 | 7.87 | 13.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | Ki | = | 13.49 | nM | 7.87 | In vitro binding affinity for human Histamine H3 receptor by displacing N-[3H]-m... | 12930154 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12930154 | 10.1021/jm030185v | Histamine H3 receptor | 1 |
Data from ChEMBL 36 via Core Engine