Compound Detail
CHEMBL392611
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CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCN(CNC(=O)C4=C(O)[C@@H](N(C)C)[C@@H]5C[C@@H]6Cc7c(N(C)C)ccc(O)c7C(=O)C6=C(O)[C@]5(O)C4=O)CC3)cc21
Basic Information
| ChEMBL ID | CHEMBL392611 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JHZDVXFAQMWQBG-MUPHQAPPSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
788.8
MW (Da)
1.77
ALogP
14
HBA
6
HBD
216.4
PSA (Ų)
0.18
QED
3
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17376679 | 10.1016/j.bmcl.2006.11.055 | Human immunodeficiency virus type 1 integrase | 2 |
| 17376679 | 10.1016/j.bmcl.2006.11.055 | CCRF-CEM | 1 |
| 17376679 | 10.1016/j.bmcl.2006.11.055 | Mycobacterium tuberculosis | 1 |
| 17376679 | 10.1016/j.bmcl.2006.11.055 | Human immunodeficiency virus 1 | 1 |
Data from ChEMBL 36 via Core Engine