Compound Detail
CHEMBL541057
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 | CHEMBL541057 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NXIDSCIYSNVGDB-UHFFFAOYSA-N |
| Parent Compound | CHEMBL1190523 |
| Active Moiety | CHEMBL1190523 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
283.4
MW (Da)
3.03
ALogP
3
HBA
2
HBD
43.7
PSA (Ų)
0.79
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | IC50 | 6.36 | 6.36 | 440.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | IC50 | = | 440.0 | nM | 6.36 | In vitro inhibition of dopamine stimulated production of [14C]-cAMP from [14C]-A... | 2878077 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2878077 | 10.1021/jm00161a029 | Rattus norvegicus | 3 |
| 2878077 | 10.1021/jm00161a029 | Canis familiaris | 1 |
Data from ChEMBL 36 via Core Engine