Compound Detail
CHEMBL1765594
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CC(=O)N[C@H]1[C@H](O[C@H]2CC[C@]3(C)[C@H]4CC=C5[C@@H]6CC(C)(C)[C@@H]7C[C@]6(C(=O)O7)[C@H](O)C[C@@]5(C)[C@]4(C)CC[C@H]3C2(C)C)O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O
Basic Information
| ChEMBL ID | CHEMBL1765594 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HCPJVMUCDGEUPL-KJFQBVHNSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
938.1
MW (Da)
0.55
ALogP
17
HBA
9
HBD
272.6
PSA (Ų)
0.09
QED
3
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21314099 | 10.1021/np100702p | NON-PROTEIN TARGET | 2 |
| 21314099 | 10.1021/np100702p | B16-F10 | 1 |
| 21314099 | 10.1021/np100702p | SK-MEL-28 | 1 |
Data from ChEMBL 36 via Core Engine