Compound Detail
CHEMBL71999
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Basic Information
| ChEMBL ID | CHEMBL71999 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ILGLDRVWVDDPCM-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
352.4
MW (Da)
2.73
ALogP
4
HBA
2
HBD
80.4
PSA (Ų)
0.51
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| GABA-A receptor; anion channel CHEMBL2094107 | Ki | 6.29 | 6.29 | 510.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| GABA-A receptor; anion channel | Ki | = | 510.0 | nM | 6.29 | In vitro inhibition of [3H]flunitrazepam binding to GABA-A benzodiazepine recept... | 1319492 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1319492 | 10.1021/jm00090a011 | GABA-A receptor; anion channel | 3 |
| 17548194 | 10.1016/j.bmcl.2007.04.035 | Leishmania donovani | 1 |
| 21524503 | 10.1016/j.ejmech.2011.03.065 | Hepatocyte growth factor receptor | 1 |
| 21524503 | 10.1016/j.ejmech.2011.03.065 | Insulin-like growth factor 1 receptor | 1 |
| 21524503 | 10.1016/j.ejmech.2011.03.065 | Proto-oncogene tyrosine-protein kinase Src | 1 |
| 22361685 | 10.1016/j.ejmech.2012.01.056 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
Data from ChEMBL 36 via Core Engine