Compound Detail
CHEMBL309378
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Basic Information
| ChEMBL ID | CHEMBL309378 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QBTIQJBWUVTGLY-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
247.3
MW (Da)
2.20
ALogP
3
HBA
2
HBD
124.4
PSA (Ų)
0.20
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.05
Ki 1 meas. best 5.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 5.1 | 5.1 | 8000.0 | 1 |
| GABA-A receptor; anion channel CHEMBL1907607 | IC50 | 5.05 | 5.05 | 9000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 8000.0 | nM | 5.1 | Inhibitory activity against sodium-dependent synaptosome uptake was determined | 3027337 |
| GABA-A receptor; anion channel | IC50 | = | 9000.0 | nM | 5.05 | Inhibition of [3H]GABA binding to Gamma-aminobutyric acid A (GABA-A) receptor of... | 3027337 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3027337 | 10.1021/jm00385a003 | GABA-A receptor; anion channel | 1 |
| 3027337 | 10.1021/jm00385a003 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine