Compound Detail
CHEMBL3397744
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CCCCCCCCCCCCCCCCCC(=O)N1C/C(=C\c2ccc(C(=O)OCC)cc2)C(=O)/C(=C/c2ccc(C(=O)OCC)cc2)C1
Basic Information
| ChEMBL ID | CHEMBL3397744 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VTYMROVRRMMYAU-JRXDEDDOSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
686.0
MW (Da)
10.18
ALogP
6
HBA
0
HBD
90.0
PSA (Ų)
0.07
QED
2
Ro5 Violations
22
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25577711 | 10.1016/j.bmc.2014.12.042 | CCRF-CEM | 1 |
| 25577711 | 10.1016/j.bmc.2014.12.042 | HeLa | 1 |
| 25577711 | 10.1016/j.bmc.2014.12.042 | L1210 | 1 |
| 25577711 | 10.1016/j.bmc.2014.12.042 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine