Compound Detail
CHEMBL5267609
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Basic Information
| ChEMBL ID | CHEMBL5267609 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VGXYIUJFMKXXNJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
222.2
MW (Da)
1.62
ALogP
4
HBA
2
HBD
70.9
PSA (Ų)
0.26
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cytochrome P450 4Z1 CHEMBL4523375 | IC50 | 7.05 | 7.05 | 89.7 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cytochrome P450 4Z1 | IC50 | = | 89.7 | nM | 7.05 | Inhibition of CYP4Z1 in human HEK293T cells using Luciferin-BE as substrate incu... | 36414390 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36414390 | 10.1021/acs.jmedchem.2c01320 | Cytochrome P450 4Z1 | 3 |
Data from ChEMBL 36 via Core Engine