Compound Detail
CHEMBL4213357
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Basic Information
| ChEMBL ID | CHEMBL4213357 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MEWSBNIVOLYKGU-UHFFFAOYSA-N |
12
Targets
20
Activities
2
Assay Types
0
PK Parameters
15
Publications
0
Known Names
Molecular Properties
511.6
MW (Da)
6.49
ALogP
4
HBA
1
HBD
46.4
PSA (Ų)
0.34
QED
2
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 12 meas. best 6.82
EC50 8 meas. best 7.22
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-6/beta-3 | 7 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-6/beta-3/gamma-2 | 7 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Unchecked | 7 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-4/beta-3/delta | 5 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-4/beta-3 | 5 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-6/beta-3/delta | 5 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-4/beta-3/gamma-2 | 4 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-6/beta-2/delta | 4 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-1/beta-3 | 4 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-1/beta-3/gamma-2 | 4 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-1/beta-3/delta | 4 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | Gamma-aminobutyric acid receptor subunit alpha-6/beta-2 | 2 |
| 29451785 | 10.1021/acs.jmedchem.7b01484 | GABA A receptor alpha-6/beta-2/gamma-2 | 2 |
| 30928713 | 10.1016/j.ejmech.2019.03.043 | Unchecked | 2 |
| 30928713 | 10.1016/j.ejmech.2019.03.043 | GABA-A receptor; alpha-1/beta-3/gamma-2 | 1 |
Data from ChEMBL 36 via Core Engine