Compound Detail
CHEMBL135897
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL135897 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ONGUNCXEJINACZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
207.7
MW (Da)
2.95
ALogP
1
HBA
1
HBD
12.0
PSA (Ų)
0.75
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 10.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-9 CHEMBL2585 | Kd | 10.57 | 10.57 | 0.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-9 | Kd | = | 0.027 | nM | 10.57 | The compound was tested for the inhibition of binding of [3H]epibatidine to cent... | 9784094 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9784094 | 10.1021/jm980233p | Neuronal acetylcholine receptor subunit alpha-9 | 1 |
Data from ChEMBL 36 via Core Engine