Compound Detail
CHEMBL1276665
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1276665 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BFROCYLJIWSNOO-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
531.7
MW (Da)
5.89
ALogP
8
HBA
2
HBD
125.9
PSA (Ų)
0.12
QED
2
Ro5 Violations
25
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 4.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human alphaherpesvirus 2 CHEMBL370 | EC50 | 4.46 | 4.46 | 35000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human alphaherpesvirus 2 | EC50 | = | 35000.0 | nM | 4.46 | Antiviral activity against herpes simplex virus 2 MS infected in HFF cells by pl... | 18852272 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18852272 | 10.1128/aac.00918-08 | Unchecked | 8 |
| 18852272 | 10.1128/aac.00918-08 | NON-PROTEIN TARGET | 5 |
| 18852272 | 10.1128/aac.00918-08 | HFF | 2 |
| 18852272 | 10.1128/aac.00918-08 | Human betaherpesvirus 5 | 1 |
| 18852272 | 10.1128/aac.00918-08 | Human alphaherpesvirus 3 | 1 |
| 18852272 | 10.1128/aac.00918-08 | Human alphaherpesvirus 2 | 1 |
| 18852272 | 10.1128/aac.00918-08 | Human alphaherpesvirus 1 | 1 |
| 18852272 | 10.1128/aac.00918-08 | MOLT-3 | 1 |
| 18852272 | 10.1128/aac.00918-08 | Daudi | 1 |
Data from ChEMBL 36 via Core Engine