Compound Detail
CHEMBL109956
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL109956 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JRPBSTGRRSTANR-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
206.3
MW (Da)
3.79
ALogP
1
HBA
1
HBD
20.2
PSA (Ų)
0.79
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Xenopus laevis CHEMBL613478 | EC50 | 6.4 | 6.4 | 398.1 | 1 |
| GABA-A receptor; alpha-1/beta-2/gamma-2 CHEMBL2095172 | EC50 | 5.6 | 5.15 | 2511.9 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Xenopus laevis | EC50 | = | 398.11 | nM | 6.4 | Loss of righting reflex (LORR) in tadpoles was determined for anesthetic activit... | 12109905 |
| GABA-A receptor; alpha-1/beta-2/gamma-2 | EC50 | = | 2511.89 | nM | 5.6 | Potentiation of GABA responses at human Gamma-aminobutyric acid A receptor alpha... | 12109905 |
| GABA-A receptor; alpha-1/beta-2/gamma-2 | EC50 | = | 19952.62 | nM | 4.7 | Direct activation of human Gamma-aminobutyric acid A receptor alpha-1-beta-2-gam... | 12109905 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12109905 | 10.1021/jm010461a | GABA-A receptor; alpha-1/beta-2/gamma-2 | 2 |
| 12109905 | 10.1021/jm010461a | Xenopus laevis | 1 |
| 12109905 | 10.1021/jm010461a | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine