Compound Detail
CHEMBL4536366
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C=C(C)[C@]12C[C@@H](COC(=O)c3ccccc3)[C@@]34OC5(O[C@@H]1[C@@H]3[C@@H]1O[C@]1(COC(=O)C1(C)COC(C)(C)OC1)[C@@H](O)[C@@]1(O)[C@H]4[C@H]([C@H](C)[C@@H]1OC(=O)c1ccccc1)[C@H](C)CCCCCC[C@H]5O)O2
Basic Information
| ChEMBL ID | CHEMBL4536366 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RGPUWCQMDOUSOF-RURWNAAUSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
931.1
MW (Da)
5.67
ALogP
15
HBA
3
HBD
198.3
PSA (Ų)
0.12
QED
3
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31343875 | 10.1021/acs.jmedchem.9b00339 | MT4 | 1 |
| 31343875 | 10.1021/acs.jmedchem.9b00339 | Protein kinase C (PKC) | 1 |
Data from ChEMBL 36 via Core Engine