Compound Detail
CHEMBL4202528
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CC(C)c1cc2c(cc1S(=O)(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccc(Br)c1)[C@@]1(C)CCC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)Nc3cccc(Br)c3)[C@@H]1CC2
Basic Information
| ChEMBL ID | CHEMBL4202528 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DASLSTMOGFISFX-BEFHDJFHSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
982.9
MW (Da)
10.24
ALogP
5
HBA
4
HBD
133.5
PSA (Ų)
0.09
QED
2
Ro5 Violations
14
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28756264 | 10.1016/j.ejmech.2017.07.020 | Stromelysin-1 | 1 |
| 28756264 | 10.1016/j.ejmech.2017.07.020 | Neutrophil collagenase | 1 |
| 28756264 | 10.1016/j.ejmech.2017.07.020 | Matrix metalloproteinase-9 | 1 |
| 28756264 | 10.1016/j.ejmech.2017.07.020 | NCI-H460 | 1 |
| 28756264 | 10.1016/j.ejmech.2017.07.020 | HepG2 | 1 |
| 28756264 | 10.1016/j.ejmech.2017.07.020 | SK-OV-3 | 1 |
| 28756264 | 10.1016/j.ejmech.2017.07.020 | MCF7 | 1 |
| 28756264 | 10.1016/j.ejmech.2017.07.020 | L02 | 1 |
Data from ChEMBL 36 via Core Engine