Compound Detail
CHEMBL1762696
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Basic Information
| ChEMBL ID | CHEMBL1762696 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UBWIYHMTQBCTLZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
431.9
MW (Da)
3.09
ALogP
6
HBA
3
HBD
110.0
PSA (Ų)
0.48
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mas-related G-protein coupled receptor member X1 CHEMBL5850 | IC50 | 6.52 | 6.52 | 301.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mas-related G-protein coupled receptor member X1 | IC50 | = | 301.0 | nM | 6.52 | Antagonist activity at SNSR4 in human HEK293 cells by FLIPR assay | 21333534 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21333534 | 10.1016/j.bmcl.2011.01.138 | Mas-related G-protein coupled receptor member X1 | 1 |
| 21333534 | 10.1016/j.bmcl.2011.01.138 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine