Compound Detail
CHEMBL227759
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Basic Information
| ChEMBL ID | CHEMBL227759 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JVKWTDRHWOSRFT-UHFFFAOYSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
291.4
MW (Da)
5.25
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.43
QED
1
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17092729 | 10.1016/j.bmc.2006.10.042 | MCF7 | 2 |
| 22440084 | 10.1016/j.bmc.2012.02.060 | NON-PROTEIN TARGET | 2 |
| 24972725 | 10.1016/j.bmc.2014.05.073 | Tyrosinase | 2 |
| 28927789 | 10.1016/j.bmcl.2017.09.005 | SK-N-AS | 2 |
| 36913882 | 10.1016/j.bmc.2023.117214 | PC-3 | 2 |
| 17092729 | 10.1016/j.bmc.2006.10.042 | DU-145 | 1 |
| 17092729 | 10.1016/j.bmc.2006.10.042 | HepG2 | 1 |
| 17092729 | 10.1016/j.bmc.2006.10.042 | HL-60 | 1 |
| 22440084 | 10.1016/j.bmc.2012.02.060 | MIA PaCa-2 | 1 |
| 36913882 | 10.1016/j.bmc.2023.117214 | MCF7 | 1 |
Data from ChEMBL 36 via Core Engine