Compound Detail
CHEMBL391681
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Basic Information
| ChEMBL ID | CHEMBL391681 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZAQHRTWFTFLZHD-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
395.3
MW (Da)
4.67
ALogP
3
HBA
2
HBD
76.9
PSA (Ų)
0.66
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 6.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Baculoviral IAP repeat-containing protein 5 CHEMBL5989 | Kd | 6.16 | 6.16 | 700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Baculoviral IAP repeat-containing protein 5 | Kd | = | 700.0 | nM | 6.16 | Binding affinity to human survivin expressed in Escherichia coli BL21 cells afte... | 17391963 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17391963 | 10.1016/j.bmcl.2007.03.042 | Baculoviral IAP repeat-containing protein 5 | 1 |
Data from ChEMBL 36 via Core Engine