Compound Detail
CHEMBL4530301
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
COc1ccccc1-n1cc(CNC(=O)[C@]23CC[C@@H](C)[C@H](C)[C@H]2C2=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)nn1
Basic Information
| ChEMBL ID | CHEMBL4530301 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DLKNLFWXOZLWQQ-ARZNILTOSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
674.9
MW (Da)
5.85
ALogP
8
HBA
4
HBD
129.7
PSA (Ų)
0.28
QED
2
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31057738 | 10.1039/C8MD00620B | A549 | 2 |
| 31057738 | 10.1039/C8MD00620B | Unchecked | 2 |
| 31057738 | 10.1039/C8MD00620B | HepG2 | 1 |
| 31057738 | 10.1039/C8MD00620B | T-24 | 1 |
| 31057738 | 10.1039/C8MD00620B | NCI-H460 | 1 |
| 31057738 | 10.1039/C8MD00620B | L02 | 1 |
Data from ChEMBL 36 via Core Engine