Compound Detail
CHEMBL423111
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CCc1ccccc1C1Cc2cc(OC(=O)C3O[C@@H](O)[C@H](O)[C@@H](O)[C@H]3O)c(CCCOc3ccccc3)cc2O1
Basic Information
| ChEMBL ID | CHEMBL423111 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OAQOWYUAUPSECR-GAAWIUQDSA-N |
0
Targets
0
Activities
0
Assay Types
1
PK Parameters
3
Publications
0
Known Names
Molecular Properties
550.6
MW (Da)
2.64
ALogP
9
HBA
4
HBD
134.9
PSA (Ų)
0.18
QED
1
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| F | - | % | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1313879 | 10.1021/jm00085a019 | Rattus norvegicus | 4 |
| 1313879 | 10.1021/jm00085a019 | Leukotriene B4 receptor 1 | 1 |
| 1313879 | 10.1021/jm00085a019 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine