Compound Detail
CHEMBL3753147
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Basic Information
| ChEMBL ID | CHEMBL3753147 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JCIUFRTZMXHLKU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
446.0
MW (Da)
4.48
ALogP
4
HBA
1
HBD
44.8
PSA (Ų)
0.70
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL264 | Ki | 8.17 | 8.17 | 6.7 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | Ki | = | 6.7 | nM | 8.17 | Displacement of [3H]R-alpha-methyl histamine from recombinant human H3 receptor | 26731168 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26731168 | 10.1016/j.ejmech.2015.12.005 | Histamine H3 receptor | 1 |
Data from ChEMBL 36 via Core Engine