Compound Detail
CHEMBL259264
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Basic Information
| ChEMBL ID | CHEMBL259264 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OVDJDGHFBGJJHZ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
360.5
MW (Da)
3.54
ALogP
4
HBA
1
HBD
35.9
PSA (Ų)
0.68
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 9.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL264 | IC50 | 9.01 | 9.01 | 1.0 | 1 |
| Acetylcholinesterase CHEMBL220 | IC50 | 6.46 | 6.46 | 350.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | IC50 | = | 0.98 | nM | 9.01 | Inhibition of histamine H3 receptor | 18249544 |
| Acetylcholinesterase | IC50 | = | 350.0 | nM | 6.46 | Inhibition of AChE | 18249544 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18249544 | 10.1016/j.bmc.2007.12.048 | Acetylcholinesterase | 1 |
| 18249544 | 10.1016/j.bmc.2007.12.048 | Histamine H3 receptor | 1 |
Data from ChEMBL 36 via Core Engine