Compound Detail
CHEMBL276596
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Basic Information
| ChEMBL ID | CHEMBL276596 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | REIIDWKAPAXVCM-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
319.4
MW (Da)
3.19
ALogP
3
HBA
1
HBD
45.2
PSA (Ų)
0.79
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.83
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L1210 CHEMBL386 | IC50 | 4.83 | 4.83 | 14700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 14700.0 | nM | 4.83 | Compound concentration that reduces cell growth of L1210 leukemia cultures to 50... | 3361574 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3361574 | 10.1021/jm00400a029 | Nucleic Acid | 2 |
| 3361574 | 10.1021/jm00400a029 | Mus musculus | 2 |
| 3361574 | 10.1021/jm00400a029 | No relevant target | 1 |
| 3361574 | 10.1021/jm00400a029 | L1210 | 1 |
Data from ChEMBL 36 via Core Engine