Compound Detail
CHEMBL5992406
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=C1N[C@]2(CO1)C[C@H](C(=O)N1CC3(CC[C@H](c4ccc(C(F)(F)F)cc4)C3)C1)C2
Basic Information
| ChEMBL ID | CHEMBL5992406 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CZIFDIHMNKXRSH-AUSJPIAWSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
408.4
MW (Da)
3.69
ALogP
3
HBA
1
HBD
58.6
PSA (Ų)
0.81
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 10.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Monoglyceride lipase CHEMBL4191 | IC50 | 10.0 | 9.53 | 0.1 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Monoglyceride lipase | IC50 | = | 0.1 | nM | 10.0 | Biological Assay: The assay used to measure the in vitro activity of MGL is adap... | - |
| Monoglyceride lipase | IC50 | = | 0.87 | nM | 9.06 | Biological Assay: The assay used to measure the in vitro activity of MGL is adap... | - |
Data from ChEMBL 36 via Core Engine