Compound Detail
CHEMBL184952
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Basic Information
| ChEMBL ID | CHEMBL184952 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LMPGZLBYDQUITL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
307.4
MW (Da)
3.40
ALogP
5
HBA
0
HBD
49.2
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Aromatase CHEMBL1978 | IC50 | 4.5 | 4.5 | 31600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Aromatase | IC50 | = | 31600.0 | nM | 4.5 | In vitro inhibition of [1,2,6,7-3H]androstenedione binding to Aromatase of human... | 15380230 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15380230 | 10.1016/j.bmcl.2004.07.090 | Aromatase | 2 |
Data from ChEMBL 36 via Core Engine