Compound Detail
CHEMBL3322870
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Basic Information
| ChEMBL ID | CHEMBL3322870 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TZZLIARCVQOPQS-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
152.2
MW (Da)
0.67
ALogP
3
HBA
2
HBD
76.2
PSA (Ų)
0.62
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 5.87
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| GABA-A receptor; anion channel CHEMBL2093872 | Ki | 5.87 | 5.86 | 1349.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| GABA-A receptor; anion channel | Ki | = | 1348.96 | nM | 5.87 | Displacement of [3H]muscimol from GABAA receptor in SPRD rat brain synaptic memb... | 25038482 |
| GABA-A receptor; anion channel | Ki | = | 1400.0 | nM | 5.85 | Displacement of [3H]muscimol from GABAA receptor in SPRD rat brain synaptic memb... | 25038482 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25038482 | 10.1016/j.ejmech.2014.07.039 | GABA-A receptor; anion channel | 2 |
| 25038482 | 10.1016/j.ejmech.2014.07.039 | GABA-A receptor; alpha-1/beta-2/gamma-2 | 1 |
| 25038482 | 10.1016/j.ejmech.2014.07.039 | Gamma-aminobutyric acid receptor subunit rho-1 | 1 |
Data from ChEMBL 36 via Core Engine