Compound Detail
CHEMBL10724
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL10724 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AVTDTIXTCDVJBC-NRFANRHFSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
373.4
MW (Da)
1.95
ALogP
7
HBA
1
HBD
105.2
PSA (Ų)
0.51
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L1210 CHEMBL386 | IC50 | 7.1 | 7.1 | 80.0 | 1 |
| DNA topoisomerase 1 CHEMBL1781 | IC50 | 5.72 | 5.72 | 1900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 80.0 | nM | 7.1 | Inhibitory activity in mice bearing L1210 leukemia | 1846923 |
| DNA topoisomerase 1 | IC50 | = | 1900.0 | nM | 5.72 | Inhibition of Topoisomerase I by cleavage complex formation in human HL-60 cells | 8410981 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1846923 | 10.1021/jm00105a017 | Mus musculus | 2 |
| 1846923 | 10.1021/jm00105a017 | DNA topoisomerase 1 | 1 |
| 1846923 | 10.1021/jm00105a017 | L1210 | 1 |
| 8410981 | 10.1021/jm00070a013 | DNA topoisomerase 1 | 1 |
Data from ChEMBL 36 via Core Engine