Compound Detail
CHEMBL5276154
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O=C(O)c1cn2c(c(O)c1=O)C(=O)N(CC1CCCC1)CN2C1c2ccccc2CCc2ccccc21
Basic Information
| ChEMBL ID | CHEMBL5276154 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RRHCTLFASBRFHR-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
499.6
MW (Da)
3.68
ALogP
6
HBA
2
HBD
103.1
PSA (Ų)
0.57
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mammarenavirus choriomeningitidis CHEMBL5291622 | EC50 | 7.77 | 7.77 | 17.0 | 1 |
| Junin virus CHEMBL4523072 | EC50 | 7.6 | 7.6 | 25.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mammarenavirus choriomeningitidis | EC50 | = | 17.0 | nM | 7.77 | Antiviral activity against Lymphocytic choriomeningitis virus | 36758821 |
| Junin virus | EC50 | = | 25.0 | nM | 7.6 | Antiviral activity against Junin virus | 36758821 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36758821 | 10.1016/j.bmcl.2023.129175 | Junin virus | 1 |
| 36758821 | 10.1016/j.bmcl.2023.129175 | Mammarenavirus choriomeningitidis | 1 |
Data from ChEMBL 36 via Core Engine