Compound Detail
CHEMBL170957
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 | CHEMBL170957 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WZMRWOJTUIQZTG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
284.4
MW (Da)
1.21
ALogP
4
HBA
2
HBD
56.7
PSA (Ų)
0.87
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.18
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L1210 CHEMBL386 | IC50 | 5.18 | 5.18 | 6600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 6600.0 | nM | 5.18 | Inhibition of L1210 cell growth by 50% | 11831901 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11831901 | 10.1021/jm000473g | Nucleic Acid | 2 |
| 11831901 | 10.1021/jm000473g | Mus musculus | 2 |
| 11831901 | 10.1021/jm000473g | No relevant target | 1 |
| 11831901 | 10.1021/jm000473g | L1210 | 1 |
Data from ChEMBL 36 via Core Engine