Compound Detail
CHEMBL4226643
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
O=C(c1cccc(/C=c2\[nH]c(=O)/c(=C/c3ccccn3)[nH]c2=O)c1)N1CCCCC1
Basic Information
| ChEMBL ID | CHEMBL4226643 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XYYJARJZKGWTTD-SGAFJUGLSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
402.4
MW (Da)
0.74
ALogP
4
HBA
2
HBD
98.9
PSA (Ų)
0.68
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29571653 | 10.1016/j.bmc.2018.03.005 | Tubulin | 1 |
| 29571653 | 10.1016/j.bmc.2018.03.005 | BXPC-3 | 1 |
| 29571653 | 10.1016/j.bmc.2018.03.005 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine