Compound Detail
CHEMBL5877870
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C[C@](O)(CS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(NC(=O)CCl)c(C(F)(F)F)c1
Basic Information
| ChEMBL ID | CHEMBL5877870 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AWXTZAYIJBMFJP-SFHVURJKSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
496.9
MW (Da)
3.19
ALogP
5
HBA
3
HBD
112.6
PSA (Ų)
0.31
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Androgen receptor CHEMBL1871 | IC50 | 6.12 | 6.12 | 750.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Androgen receptor | IC50 | = | 750.0 | nM | 6.12 | Gal4-luciferase reporter assay: Briefly, the AR LBD is expressed as a fusion wit... | - |
Data from ChEMBL 36 via Core Engine