Compound Detail
CHEMBL610947
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Basic Information
| ChEMBL ID | CHEMBL610947 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WCDLKFDMGMUZSG-POGOCJABSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
371.2
MW (Da)
0.90
ALogP
8
HBA
3
HBD
113.5
PSA (Ų)
0.61
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HFF CHEMBL614071 | IC50 | 4.5 | 4.425 | 32000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HFF | IC50 | = | 32000.0 | nM | 4.5 | Antiviral activity against towne strain HCMV was determined by plaque reduction ... | 10882370 |
| HFF | IC50 | = | 45000.0 | nM | 4.35 | Visual cytotoxicity against stationary human foreskin fibroblasts (HFF) cells at... | 10882370 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10882370 | 10.1021/jm990290y | HFF | 2 |
| 10882370 | 10.1021/jm990290y | Human alphaherpesvirus 1 | 1 |
| 10882370 | 10.1021/jm990290y | ADMET | 1 |
Data from ChEMBL 36 via Core Engine