Compound Detail
CHEMBL3134115
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Basic Information
| ChEMBL ID | CHEMBL3134115 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SNHQMOIKQSCRFM-HNNXBMFYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
284.3
MW (Da)
3.42
ALogP
4
HBA
1
HBD
55.8
PSA (Ų)
0.92
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Aromatase CHEMBL1978 | IC50 | 6.22 | 6.22 | 600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Aromatase | IC50 | = | 600.0 | nM | 6.22 | Inhibition of human recombinant aromatase expressed in baculovirus infected inse... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C3MD00166K | NON-PROTEIN TARGET | 2 |
| - | 10.1039/C3MD00166K | A549 | 1 |
| - | 10.1039/C3MD00166K | HepG2 | 1 |
| - | 10.1039/C3MD00166K | Aromatase | 1 |
Data from ChEMBL 36 via Core Engine