Compound Detail
CHEMBL4854087
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C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)O)C(N)=O
Basic Information
| ChEMBL ID | CHEMBL4854087 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XMHNQYAZILYHFF-HJASKWMTSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
13
Publications
0
Known Names
Molecular Properties
943.1
MW (Da)
-7.20
ALogP
15
HBA
17
HBD
465.2
PSA (Ų)
0.02
QED
3
Ro5 Violations
32
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34180670 | 10.1021/acs.jmedchem.1c00614 | ADMET | 4 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Bacteria | 3 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Staphylococcus aureus | 1 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Bacillus subtilis | 1 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Enterococcus faecalis | 1 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Staphylococcus epidermidis | 1 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Escherichia coli | 1 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Pseudomonas aeruginosa | 1 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Klebsiella pneumoniae | 1 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Acinetobacter baumannii | 1 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Erythrocyte | 1 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Unchecked | 1 |
| 34180670 | 10.1021/acs.jmedchem.1c00614 | Fungi | 1 |
Data from ChEMBL 36 via Core Engine