Compound Detail
CHEMBL442156
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Basic Information
| ChEMBL ID | CHEMBL442156 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MWTQQMOGWWDKEL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
192.3
MW (Da)
2.20
ALogP
2
HBA
1
HBD
24.4
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nischarin CHEMBL3923 | Ki | 6.19 | 6.19 | 645.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nischarin | Ki | = | 645.65 | nM | 6.19 | Displacement of [3H]clonidine from imidazoline receptor I-1 of bovine chromaffin... | 11334568 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11334568 | 10.1021/jm001111b | Nischarin | 1 |
| 11334568 | 10.1021/jm001111b | Monoamine oxidase | 1 |
| 11334568 | 10.1021/jm001111b | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine