Compound Detail
CHEMBL380389
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CC(C)c1c(NC(=O)Nc2ccc(C(F)(F)F)cc2)c(=O)n(-c2cnc3ccccc3c2)n1C
Basic Information
| ChEMBL ID | CHEMBL380389 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GWBITAQAPMSVBY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
469.5
MW (Da)
5.51
ALogP
5
HBA
2
HBD
81.0
PSA (Ų)
0.41
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| N-formyl peptide receptor 2 CHEMBL4227 | EC50 | 7.36 | 7.36 | 44.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| N-formyl peptide receptor 2 | EC50 | = | 44.0 | nM | 7.36 | Activity at human FPRL1-mediated calcium mobilization in CHO cells | 16697190 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16697190 | 10.1016/j.bmcl.2006.04.068 | N-formyl peptide receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine