Compound Detail
CHEMBL371070
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Basic Information
| ChEMBL ID | CHEMBL371070 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KYBALDDLTQQPNW-BDAKNGLRSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
223.3
MW (Da)
0.55
ALogP
5
HBA
2
HBD
81.1
PSA (Ų)
0.77
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.21
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human alphaherpesvirus 1 CHEMBL377 | EC50 | 4.21 | 4.21 | 62000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human alphaherpesvirus 1 | EC50 | = | 62000.0 | nM | 4.21 | Effective concentration required to inhibit herpes simplex virus type 1 Kos stra... | 15658858 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15658858 | 10.1021/jm0493966 | Coxsackievirus | 1 |
| 15658858 | 10.1021/jm0493966 | Human alphaherpesvirus 1 | 1 |
Data from ChEMBL 36 via Core Engine