Compound Detail
CHEMBL4633534
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Basic Information
| ChEMBL ID | CHEMBL4633534 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CAISHEUSYLPYMJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
327.6
MW (Da)
3.26
ALogP
3
HBA
3
HBD
52.2
PSA (Ų)
0.75
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Complement factor B CHEMBL5731 | IC50 | 4.96 | 4.96 | 11000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Complement factor B | IC50 | = | 11000.0 | nM | 4.96 | Inhibition of human serine protease factor B catalytic domain (D470 to L764 resi... | 32073845 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32073845 | 10.1021/acs.jmedchem.9b01870 | Complement factor B | 1 |
Data from ChEMBL 36 via Core Engine