Compound Detail
CHEMBL1642473
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Basic Information
| ChEMBL ID | CHEMBL1642473 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KIDKROUQSPXENS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
424.9
MW (Da)
4.54
ALogP
5
HBA
0
HBD
43.7
PSA (Ų)
0.53
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Melanin-concentrating hormone receptor 1 CHEMBL344 | IC50 | 7.92 | 7.92 | 12.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Melanin-concentrating hormone receptor 1 | IC50 | = | 12.0 | nM | 7.92 | Displacement of [125I]MCH from human MCHR1 expressed in CHO cells by competition... | 21190859 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21190859 | 10.1016/j.bmc.2010.12.002 | Melanin-concentrating hormone receptor 1 | 2 |
| 21190859 | 10.1016/j.bmc.2010.12.002 | Voltage-gated inwardly rectifying potassium channel KCNH2 | 1 |
Data from ChEMBL 36 via Core Engine