Compound Detail
CHEMBL376361
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CC(=O)O[C@@]12COC1C[C@H](O)[C@@]1(C)C(=O)[C@H](O)C3=C(C)[C@@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)c4ccccc4)C[C@@](O)([C@@H](OC(=O)N4CCC[C@H]4C(=O)NCC(=O)NCC(=O)O)C21)C3(C)C
Basic Information
| ChEMBL ID | CHEMBL376361 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KDIZJRHRQXOYEP-BFZJCNEMSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
959.0
MW (Da)
0.32
ALogP
17
HBA
8
HBD
323.2
PSA (Ų)
0.08
QED
3
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17064914 | 10.1016/j.bmc.2006.09.030 | Tubulin | 1 |
| 17064914 | 10.1016/j.bmc.2006.09.030 | KB | 1 |
Data from ChEMBL 36 via Core Engine