Compound Detail
CHEMBL3114424
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=C1C(Cl)=C(NCc2cn(CCCCN3C(=O)c4ccccc4C3=O)nn2)C(=O)c2ccccc21
Basic Information
| ChEMBL ID | CHEMBL3114424 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZMDPOHWNZLDPLZ-UHFFFAOYSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
13
Publications
0
Known Names
Molecular Properties
489.9
MW (Da)
2.97
ALogP
8
HBA
1
HBD
114.3
PSA (Ų)
0.38
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24530030 | 10.1016/j.bmc.2014.01.033 | NON-PROTEIN TARGET | 2 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | V79 | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | L929 | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | PBMC | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | MX1 | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | MCF7 | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | DU-145 | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | PC-3 | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | HCT-116 | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | SF-295 | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | MDA-MB-435 | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | OVCAR-8 | 1 |
| 24530030 | 10.1016/j.bmc.2014.01.033 | HL-60 | 1 |
Data from ChEMBL 36 via Core Engine