Compound Detail
CHEMBL271716
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
CCC1(O)CC(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc(Cl)c(F)cc1c2C[n+]1ccccc1.[Cl-]
Basic Information
| ChEMBL ID | CHEMBL271716 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WCHVAIAIKRHZSS-UHFFFAOYSA-M |
| Parent Compound | CHEMBL1182899 |
| Active Moiety | CHEMBL1182899 |
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
506.9
MW (Da)
3.60
ALogP
6
HBA
1
HBD
85.3
PSA (Ų)
0.30
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas.
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18207748 | 10.1016/j.bmc.2007.10.046 | A549 | 2 |
| 18207748 | 10.1016/j.bmc.2007.10.046 | LoVo | 1 |
| 18207748 | 10.1016/j.bmc.2007.10.046 | MCF7 | 1 |
Data from ChEMBL 36 via Core Engine