Compound Detail
CHEMBL5563824
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C=C[C@]1(C)C[C@@H](OC(=O)Cn2cc(-c3ccc(Cn4cnc5c(N)nc(N)nc54)cc3)nn2)[C@]2(C)[C@H](C)CC[C@]3(CCC(=O)[C@H]32)[C@@H](C)[C@@H]1O
Basic Information
| ChEMBL ID | CHEMBL5563824 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PBAXYQVAHBLNPD-VJQSGHSNSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
667.8
MW (Da)
4.20
ALogP
13
HBA
3
HBD
189.9
PSA (Ų)
0.19
QED
2
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38385364 | 10.1021/acs.jmedchem.3c02153 | Enterococcus faecium | 2 |
| 38385364 | 10.1021/acs.jmedchem.3c02153 | No relevant target | 1 |
| 38385364 | 10.1021/acs.jmedchem.3c02153 | Unchecked | 1 |
| 38385364 | 10.1021/acs.jmedchem.3c02153 | Staphylococcus aureus | 1 |
| 38385364 | 10.1021/acs.jmedchem.3c02153 | Streptococcus pneumoniae | 1 |
| 38385364 | 10.1021/acs.jmedchem.3c02153 | Enterococcus faecalis | 1 |
| 38385364 | 10.1021/acs.jmedchem.3c02153 | MDCK-MDR1 | 1 |
Data from ChEMBL 36 via Core Engine