Compound Detail
CHEMBL1698464
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Basic Information
| ChEMBL ID | CHEMBL1698464 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GFNKOHYICHFZDD-ZHZULCJRSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
428.4
MW (Da)
5.55
ALogP
3
HBA
1
HBD
62.8
PSA (Ų)
0.46
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.03
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Melanocortin receptor 4 CHEMBL259 | IC50 | 5.03 | 5.03 | 9388.0 | 1 |
| C-C chemokine receptor type 6 CHEMBL4423 | IC50 | 4.66 | 4.66 | 22000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Melanocortin receptor 4 | IC50 | = | 9388.0 | nM | 5.03 | PUBCHEM_BIOASSAY: TRFRET-based cell-based high throughput dose response assay fo... | - |
| C-C chemokine receptor type 6 | IC50 | = | 22000.0 | nM | 4.66 | PUBCHEM_BIOASSAY: Dose Response confirmation of small molecule antagonists of th... | - |
Data from ChEMBL 36 via Core Engine