Compound Detail
CHEMBL25053
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Basic Information
| ChEMBL ID | CHEMBL25053 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HTLZVHNRZJPSMI-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
113.2
MW (Da)
1.49
ALogP
1
HBA
0
HBD
3.2
PSA (Ų)
0.50
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 5.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuronal acetylcholine receptor CHEMBL2094110 | Kd | 5.48 | 5.48 | 3300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuronal acetylcholine receptor | Kd | = | 3300.0 | nM | 5.48 | Ability to enhance the binding of (+/-)-[3H]nicotine to the rat brain P2 fractio... | 4032427 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 4032427 | 10.1021/jm00147a021 | Neuronal acetylcholine receptor | 6 |
Data from ChEMBL 36 via Core Engine