Compound Detail
CHEMBL229896
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Basic Information
| ChEMBL ID | CHEMBL229896 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UJFPPAIJOJGHOU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
299.5
MW (Da)
1.93
ALogP
4
HBA
0
HBD
57.1
PSA (Ų)
0.47
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 6.48 | 6.48 | 332.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 332.0 | nM | 6.48 | Displacement of [3H]flumazenil from bovine brain cortex GABAA/Bz receptor | 17306981 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17306981 | 10.1016/j.bmc.2007.01.053 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine