Compound Detail
CHEMBL137304
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Basic Information
| ChEMBL ID | CHEMBL137304 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SBMIVUVRFPGOEB-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
340.4
MW (Da)
6.85
ALogP
1
HBA
0
HBD
13.1
PSA (Ų)
0.41
QED
1
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.13
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Aryl hydrocarbon receptor CHEMBL3201 | EC50 | 7.13 | 7.13 | 74.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Aryl hydrocarbon receptor | EC50 | = | 74.13 | nM | 7.13 | Affinity on cytosolic Aromatic hydrocarbon receptor (Ah) | 9435905 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9435905 | 10.1021/jm970488n | Aryl hydrocarbon receptor | 1 |
Data from ChEMBL 36 via Core Engine