Compound Detail
CHEMBL6014082
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Basic Information
| ChEMBL ID | CHEMBL6014082 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QVJJMRPEYJWFNT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
436.6
MW (Da)
2.32
ALogP
7
HBA
2
HBD
73.9
PSA (Ų)
0.66
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Beta-glucuronidase CHEMBL2728 | IC50 | 6.92 | 6.92 | 120.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Beta-glucuronidase | IC50 | = | 120.0 | nM | 6.92 | β-Glucuronidase Activity Assay: The β-glucuronidase assay was performed by the a... | - |
Data from ChEMBL 36 via Core Engine