Compound Detail
CHEMBL148204
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Basic Information
| ChEMBL ID | CHEMBL148204 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GHCKERHPOQWERJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
194.2
MW (Da)
2.97
ALogP
2
HBA
1
HBD
38.9
PSA (Ų)
0.44
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 3A CHEMBL1899 | Ki | 6.0 | 6.0 | 1000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 3A | Ki | = | 1000.0 | nM | 6.0 | Displacement of [3H]granisetron from human 5-HT3AR expressed in HEK293 cells aft... | 21782429 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6737429 | 10.1021/jm00373a010 | Trypanosoma brucei | 8 |
| 6979630 | 10.1021/jm00343a600 | Streptococcus pyogenes | 1 |
| 21782429 | 10.1016/j.bmcl.2011.06.123 | Histamine H4 receptor | 1 |
| 21782429 | 10.1016/j.bmcl.2011.06.123 | 5-hydroxytryptamine receptor 3A | 1 |
Data from ChEMBL 36 via Core Engine