Compound Detail
CHEMBL3764287
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Basic Information
| ChEMBL ID | CHEMBL3764287 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CKGIFPMJNXWDKN-UHFFFAOYSA-N |
| Parent Compound | CHEMBL3765922 |
| Active Moiety | CHEMBL3765922 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
239.3
MW (Da)
2.13
ALogP
3
HBA
0
HBD
19.4
PSA (Ų)
0.76
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 6.38 | 6.38 | 412.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 412.0 | nM | 6.38 | Displacement of [3H]cytisine from Wistar rat cerebral cortex alpha4beta2* nAChR ... | 26840365 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26840365 | 10.1016/j.ejmech.2016.01.025 | Unchecked | 7 |
| 26840365 | 10.1016/j.ejmech.2016.01.025 | Neuronal acetylcholine receptor subunit alpha-7 | 1 |
Data from ChEMBL 36 via Core Engine