Compound Detail
CHEMBL3818706
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Basic Information
| ChEMBL ID | CHEMBL3818706 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CYBHECFCNVAAOA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
2
PK Parameters
3
Publications
0
Known Names
Molecular Properties
323.2
MW (Da)
4.05
ALogP
2
HBA
1
HBD
44.0
PSA (Ų)
0.83
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 10.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Androgen receptor CHEMBL1871 | EC50 | 10.5 | 10.5 | 0.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| F | 37.0 | % | Rattus norvegicus |
| T1/2 | 10.0 | hr | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Androgen receptor | EC50 | = | 0.03162 | nM | 10.5 | Modulation of human androgen receptor expressed in African green monkey CV1 cell... | 26819671 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26819671 | 10.1021/acsmedchemlett.5b00377 | Rattus norvegicus | 2 |
| 26819671 | 10.1021/acsmedchemlett.5b00377 | No relevant target | 1 |
| 26819671 | 10.1021/acsmedchemlett.5b00377 | Androgen receptor | 1 |
Data from ChEMBL 36 via Core Engine