Compound Detail
CHEMBL3908630
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COC(=O)CCC(=O)N[C@H]1C[C@]2(C)[C@H]3CC[C@@H]4[C@H]5[C@H]6OC[C@@]5(CCC6(C)C)CC[C@@]4(C)[C@]3(C)CC[C@H]2C(C)(C)[C@H]1O
Basic Information
| ChEMBL ID | CHEMBL3908630 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VLFSUQNLKMJCJA-HQASCKEPSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
571.8
MW (Da)
6.29
ALogP
5
HBA
2
HBD
84.9
PSA (Ų)
0.39
QED
2
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27236068 | 10.1016/j.ejmech.2016.05.029 | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine