Compound Detail
CHEMBL384120
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
Oc1ccc([C@@H]2c3c(O)cc(O)cc3[C@@H]3c4c(cc(O)cc4[C@H]2[C@@H]2c4cc(O)cc5c4[C@@H](c4cc(O)cc(O)c4[C@H]2c2ccc(O)cc2)[C@H](c2ccc(O)cc2)O5)O[C@H]3c2ccc(O)cc2)cc1
Basic Information
| ChEMBL ID | CHEMBL384120 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YQQUILZPDYJDQJ-KGDQSQJYSA-N |
6
Targets
9
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
906.9
MW (Da)
10.43
ALogP
12
HBA
10
HBD
220.8
PSA (Ų)
0.08
QED
4
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 9 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Angiotensin-converting enzyme 2 CHEMBL3736 | IC50 | 6.6 | 6.6 | 250.0 | 1 |
| Human alphaherpesvirus 1 CHEMBL377 | IC50 | 5.55 | 5.55 | 2800.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.54 | 5.3 | 2900.0 | 2 |
| Human alphaherpesvirus 2 CHEMBL370 | IC50 | 5.19 | 5.19 | 6400.0 | 1 |
| Influenza A virus CHEMBL613740 | IC50 | 5.19 | 5.19 | 6400.0 | 1 |
| Aldo-keto reductase family 1 member B1 CHEMBL2622 | IC50 | 4.16 | 4.16 | 69000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine