Compound Detail
CHEMBL2062587
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Basic Information
| ChEMBL ID | CHEMBL2062587 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SIRJGOXQWBRPMK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
257.3
MW (Da)
4.92
ALogP
1
HBA
1
HBD
12.0
PSA (Ų)
0.51
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| U-937 CHEMBL612794 | IC50 | 6.77 | 6.77 | 170.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| U-937 | IC50 | = | 170.0 | nM | 6.77 | Cytotoxicity in UV-irradiated human U937 cells exposed to photosensitizer for 2 ... | 24900465 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24900465 | 10.1021/ml200266v | U-937 | 1 |
Data from ChEMBL 36 via Core Engine