Compound Detail
CHEMBL1093386
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Basic Information
| ChEMBL ID | CHEMBL1093386 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JGAZOHMOTHWFOQ-NMMTYZSQSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
226.3
MW (Da)
2.90
ALogP
2
HBA
2
HBD
57.5
PSA (Ų)
0.47
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.67
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.67 | 4.67 | 21400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 21400.0 | nM | 4.67 | Inhibition of CRM1 interaction with HIV1 HA-tagged Rev in HeLa cells assessed as... | 20176483 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20176483 | 10.1016/j.bmcl.2010.01.165 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine