Compound Detail
CHEMBL3808466
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COC(=O)c1cc2cc(NCc3cc(NC(=O)c4ccc(CN5CCN(C)CC5)cc4)ccc3C)cnc2[nH]1
Basic Information
| ChEMBL ID | CHEMBL3808466 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MPKPLIIMXGFXDA-UHFFFAOYSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
526.6
MW (Da)
4.27
ALogP
7
HBA
3
HBD
102.6
PSA (Ų)
0.29
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27010810 | 10.1021/acs.jmedchem.6b00087 | HUVEC | 1 |
| 27010810 | 10.1021/acs.jmedchem.6b00087 | Fibroblast growth factor receptor 2 | 1 |
| 27010810 | 10.1021/acs.jmedchem.6b00087 | Serine/threonine-protein kinase B-raf | 1 |
| 27010810 | 10.1021/acs.jmedchem.6b00087 | Epidermal growth factor receptor | 1 |
| 27010810 | 10.1021/acs.jmedchem.6b00087 | Platelet-derived growth factor receptor alpha | 1 |
| 27010810 | 10.1021/acs.jmedchem.6b00087 | Proto-oncogene tyrosine-protein kinase Src | 1 |
| 27010810 | 10.1021/acs.jmedchem.6b00087 | Vascular endothelial growth factor receptor 2 | 1 |
| 27010810 | 10.1021/acs.jmedchem.6b00087 | HepG2 | 1 |
Data from ChEMBL 36 via Core Engine