Compound Detail
CHEMBL3343992
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Basic Information
| ChEMBL ID | CHEMBL3343992 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YKCDVZGMEHGJGV-MLCCFXAWSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
354.4
MW (Da)
0.20
ALogP
4
HBA
6
HBD
160.1
PSA (Ų)
0.31
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 4.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mas-related G-protein coupled receptor member X1 CHEMBL3341576 | EC50 | 4.5 | 4.5 | 31622.8 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mas-related G-protein coupled receptor member X1 | EC50 | = | 31622.78 | nM | 4.5 | Agonist activity at mouse MrgC11 transfected in HEK293 cells by FLIPR assay | 25288495 |
| Mas-related G-protein coupled receptor member X1 | EC50 | = | 31622.78 | nM | 4.5 | Agonist activity at mouse MrgC11 transfected in HEK293 cells by FLIPR assay | 25288495 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25288495 | 10.1016/j.bmc.2014.09.025 | Mas-related G-protein coupled receptor member X1 | 6 |
Data from ChEMBL 36 via Core Engine