Compound Detail
CHEMBL345221
AMAROLIDE Enter ChEMBL ID:
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C[C@@H]1C[C@H](O)C(=O)[C@]2(C)[C@H]3[C@H](O)C(=O)[C@H](C)[C@@H]4CC(=O)O[C@H](C[C@@H]12)[C@]34C
Basic Information
| ChEMBL ID | CHEMBL345221 |
| Name | AMAROLIDE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UNWAHVGSROASNT-HXNJGWPRSA-N |
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
364.4
MW (Da)
1.12
ALogP
6
HBA
2
HBD
100.9
PSA (Ų)
0.62
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas.
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8984156 | 10.1021/np960013j | Plasmodium falciparum | 2 |
| 23290052 | 10.1016/j.bmcl.2012.11.116 | HepG2 | 2 |
| - | 10.1016/0960-894X(96)00096-0 | H9 | 1 |
| - | 10.1016/0960-894X(96)00096-0 | Human immunodeficiency virus 1 | 1 |
| - | 10.1016/0960-894X(96)00096-0 | ADMET | 1 |
| 8984156 | 10.1021/np960013j | K562 | 1 |
| 8984156 | 10.1021/np960013j | KB | 1 |
| 8984156 | 10.1021/np960013j | BT-549 | 1 |
| 8984156 | 10.1021/np960013j | SK-OV-3 | 1 |
| 8984156 | 10.1021/np960013j | Vero | 1 |
| 23290052 | 10.1016/j.bmcl.2012.11.116 | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine