Compound Detail
CHEMBL3561444
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Basic Information
| ChEMBL ID | CHEMBL3561444 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WFAJXYUGEDUPHA-LFYBBSHMSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
479.4
MW (Da)
3.39
ALogP
4
HBA
0
HBD
66.9
PSA (Ų)
0.60
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.84
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| G-protein coupled receptor 183 CHEMBL3259470 | IC50 | 7.84 | 7.84 | 14.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| G-protein coupled receptor 183 | IC50 | = | 14.3 | nM | 7.84 | PubChem BioAssay. SAR confirmation of small molecule antagonists of the EBI2 rec... | - |
Data from ChEMBL 36 via Core Engine