Compound Detail
CHEMBL576234
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Basic Information
| ChEMBL ID | CHEMBL576234 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KKVXRFAQMOVXOX-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
474.6
MW (Da)
4.10
ALogP
6
HBA
1
HBD
66.9
PSA (Ų)
0.45
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 5.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 CHEMBL4980 | EC50 | 5.55 | 5.55 | 2840.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 | EC50 | = | 2840.0 | nM | 5.55 | Agonist activity at rat alpha7 nAChR expressed in rat GH4C1 cells assessed as ca... | 19515567 |
| Neuronal acetylcholine receptor subunit alpha-7 | EC50 | = | 2840.0 | nM | 5.55 | Displacement of [3H]epibatidine from rat alpha7 nAChR expressed in HEK292 cells ... | 22410083 |
| Neuronal acetylcholine receptor subunit alpha-7 | EC50 | = | 2840.0 | nM | 5.55 | Agonist activity at rat alpha7 nAChR expressed in GH4C1 cells by fluorescent cal... | 25827398 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19515567 | 10.1016/j.bmc.2009.05.040 | Neuronal acetylcholine receptor subunit alpha-7 | 1 |
| 22410083 | 10.1016/j.bmcl.2012.02.052 | Neuronal acetylcholine receptor subunit alpha-7 | 1 |
| 25827398 | 10.1016/j.ejmech.2015.03.025 | Neuronal acetylcholine receptor subunit alpha-7 | 1 |
Data from ChEMBL 36 via Core Engine