Compound Detail
CHEMBL3890007
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Basic Information
| ChEMBL ID | CHEMBL3890007 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DWADNGGOMAZJCY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
333.3
MW (Da)
3.05
ALogP
3
HBA
0
HBD
37.6
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 6.75 | 6.75 | 180.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 180.0 | nM | 6.75 | Displacement of [3H]-flunitrazepam from rat brain GABA-A receptor benzodiazepine... | 27598234 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27598234 | 10.1016/j.ejmech.2016.08.059 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine