Compound Detail
CHEMBL2418137
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CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)SCCOCCS)N(C)C1
Basic Information
| ChEMBL ID | CHEMBL2418137 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RQLNCHYBLIFRLS-AAAIZHQZSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
526.8
MW (Da)
0.83
ALogP
10
HBA
5
HBD
111.5
PSA (Ų)
0.18
QED
1
Ro5 Violations
13
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23786357 | 10.1021/jm400707f | Escherichia coli | 2 |
| 23786357 | 10.1021/jm400707f | Staphylococcus aureus | 2 |
| 23786357 | 10.1021/jm400707f | Bacillus subtilis | 2 |
| 23786357 | 10.1021/jm400707f | Streptococcus pyogenes | 1 |
| 23786357 | 10.1021/jm400707f | Staphylococcus epidermidis | 1 |
| 23786357 | 10.1021/jm400707f | Haemophilus influenzae | 1 |
| 23786357 | 10.1021/jm400707f | Bacillus anthracis | 1 |
| 23786357 | 10.1021/jm400707f | Listeria monocytogenes | 1 |
| 23786357 | 10.1021/jm400707f | Bacillus cereus | 1 |
| 23786357 | 10.1021/jm400707f | Mycolicibacterium smegmatis | 1 |
Data from ChEMBL 36 via Core Engine