Compound Detail
CHEMBL3235495
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Basic Information
| ChEMBL ID | CHEMBL3235495 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QLRNTKYYDKUMQG-BJUDXGSMSA-N |
| Parent Compound | CHEMBL2151569 |
| Active Moiety | CHEMBL2151569 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
319.4
MW (Da)
2.62
ALogP
4
HBA
1
HBD
48.0
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 9.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 CHEMBL2492 | Ki | 9.62 | 9.62 | 0.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 | Ki | = | 0.24 | nM | 9.62 | Binding affinity to alpha7 nAChR (unknown origin) | 24050653 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24050653 | 10.1021/jm401184f | Neuronal acetylcholine receptor subunit alpha-7 | 1 |
| 24050653 | 10.1021/jm401184f | Nucleic Acid | 1 |
Data from ChEMBL 36 via Core Engine