Compound Detail
CHEMBL288216
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CC[C@H]1OC(=O)[C@H](C)[C@@H](O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C
Basic Information
| ChEMBL ID | CHEMBL288216 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZQHDNOPMHPQULD-XPTBBACVSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
753.4
MW (Da)
4.88
ALogP
11
HBA
2
HBD
144.3
PSA (Ų)
0.35
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15006412 | 10.1016/j.bmcl.2003.12.059 | Gonadotropin-releasing hormone receptor | 1 |
| 15006412 | 10.1016/j.bmcl.2003.12.059 | Staphylococcus aureus | 1 |
| 15006412 | 10.1016/j.bmcl.2003.12.059 | Staphylococcus epidermidis | 1 |
| 15006412 | 10.1016/j.bmcl.2003.12.059 | Micrococcus luteus | 1 |
| 15006412 | 10.1016/j.bmcl.2003.12.059 | Enterococcus faecium | 1 |
| 15006412 | 10.1016/j.bmcl.2003.12.059 | Streptococcus agalactiae | 1 |
Data from ChEMBL 36 via Core Engine