Compound Detail
CHEMBL512873
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Basic Information
| ChEMBL ID | CHEMBL512873 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KSQKNCXHKSMPJW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
435.5
MW (Da)
3.34
ALogP
7
HBA
0
HBD
65.8
PSA (Ų)
0.49
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Melanin-concentrating hormone receptor 1 CHEMBL344 | IC50 | 7.08 | 7.08 | 83.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Melanin-concentrating hormone receptor 1 | IC50 | = | 83.18 | nM | 7.08 | Antagonist activity at MCH1R expressed in CHO cells assessed as intracellular Ca... | 19290642 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19290642 | 10.1021/jm8016199 | Melanin-concentrating hormone receptor 1 | 1 |
| 19290642 | 10.1021/jm8016199 | Voltage-gated inwardly rectifying potassium channel KCNH2 | 1 |
Data from ChEMBL 36 via Core Engine