Compound Detail
CHEMBL143213
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Basic Information
| ChEMBL ID | CHEMBL143213 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FUKKHCVWQVFMPA-CCNFQMFXSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
315.2
MW (Da)
1.88
ALogP
3
HBA
2
HBD
50.9
PSA (Ų)
0.78
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 9.28
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 9.28 | 9.28 | 0.5 | 1 |
| Neuronal acetylcholine receptor subunit alpha-7 CHEMBL4980 | Ki | 7.47 | 7.47 | 34.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 0.52 | nM | 9.28 | Inhibition of [3H]- epibatidine binding at the Nicotinic acetylcholine receptor ... | 12361403 |
| Neuronal acetylcholine receptor subunit alpha-7 | Ki | = | 34.1 | nM | 7.47 | Inhibition of [125I]- iodo-MLA binding at the Nicotinic acetylcholine receptor a... | 12361403 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12361403 | 10.1021/jm0202268 | Rattus norvegicus | 3 |
| 12361403 | 10.1021/jm0202268 | Unchecked | 1 |
| 12361403 | 10.1021/jm0202268 | Neuronal acetylcholine receptor subunit alpha-7 | 1 |
Data from ChEMBL 36 via Core Engine