Compound Detail
CHEMBL4205398
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
COC(=O)c1ccc(COc2ccc(Cl)cc2CN2CCN(C(=O)CNC(=O)CC34CC5CC(CC(C5)C3)C4)CC2)cc1
Basic Information
| ChEMBL ID | CHEMBL4205398 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DHFNLCDOXAUBRW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
608.2
MW (Da)
5.07
ALogP
6
HBA
1
HBD
88.2
PSA (Ų)
0.38
QED
2
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ebolavirus CHEMBL4434621 | IC50 | 8.96 | 8.96 | 1.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ebolavirus | IC50 | = | 1.1 | nM | 8.96 | Antiviral activity against VSV pseudotyped Ebolavirus expressing M-GFP infected ... | 29920098 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29920098 | 10.1021/acs.jmedchem.8b00704 | Ebolavirus | 1 |
Data from ChEMBL 36 via Core Engine