Compound Detail
CHEMBL124688
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
O=C(N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(c2cccc(Cl)c2Cn2cncn2)CC1)[C@H]1Cc2ccccc2CN1
Basic Information
| ChEMBL ID | CHEMBL124688 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WLVMBBRKTBSPIQ-FQLXRVMXSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
618.6
MW (Da)
3.72
ALogP
7
HBA
2
HBD
95.4
PSA (Ų)
0.31
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.33
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Melanocortin receptor 4 CHEMBL259 | EC50 | 6.33 | 6.33 | 470.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Melanocortin receptor 4 | EC50 | = | 470.0 | nM | 6.33 | Agonistic activity measured as inhibition of cAMP accumulation in HEK cells expr... | 14552781 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14552781 | 10.1016/s0960-894x(03)00796-0 | Melanocortin receptor 4 | 2 |
Data from ChEMBL 36 via Core Engine