Compound Detail
CHEMBL5219797
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Basic Information
| ChEMBL ID | CHEMBL5219797 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KQBVPKAUZXITDR-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
475.9
MW (Da)
1.46
ALogP
6
HBA
3
HBD
130.6
PSA (Ų)
0.41
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Complement factor D CHEMBL2176771 | IC50 | 5.89 | 5.47 | 1300.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Complement factor D | IC50 | = | 1300.0 | nM | 5.89 | Inhibition of human complement factor D using Z-L-Lys-SBzl hydrochloride as subs... | 36272185 |
| Complement factor D | IC50 | = | 5500.0 | nM | 5.26 | Inhibition Assay: An established esterolytic assay for the measurement of Factor... | - |
| Complement factor D | IC50 | = | 5500.0 | nM | 5.26 | Factor D Esterolytic Assay: An established esterolytic assay for the measurement... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36272185 | 10.1016/j.bmc.2022.117034 | Complement factor D | 1 |
| 36272185 | 10.1016/j.bmc.2022.117034 | Erythrocyte | 1 |
Data from ChEMBL 36 via Core Engine