Compound Detail
CHEMBL1883743
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C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O.O
Basic Information
| ChEMBL ID | CHEMBL1883743 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PGHSKTKIQIBATG-ZAAWVBGYSA-N |
| Parent Compound | CHEMBL226335 |
| Active Moiety | CHEMBL226335 |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
610.5
MW (Da)
-1.69
ALogP
16
HBA
10
HBD
269.4
PSA (Ų)
0.14
QED
3
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27411733 | 10.1021/acs.jmedchem.6b00698 | Unchecked | 1 |
| 27411733 | 10.1021/acs.jmedchem.6b00698 | Trypanosoma brucei brucei | 1 |
Data from ChEMBL 36 via Core Engine