Compound Detail
CHEMBL520063
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CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNC(=O)/C=C/c4c(C)[nH]c(=O)[nH]c4=O)cc3)c(F)c2)C(=O)O1
Basic Information
| ChEMBL ID | CHEMBL520063 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FPQWTZFXYUIJHS-XTXLJPNXSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
535.5
MW (Da)
1.97
ALogP
6
HBA
4
HBD
153.5
PSA (Ų)
0.32
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Escherichia coli CHEMBL354 | IC50 | 7.52 | 7.52 | 30.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 7.52 | 6.4467 | 30.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Escherichia coli | IC50 | = | 30.0 | nM | 7.52 | Inhibition of protein synthesis in Escherichia coli S30 extract by translation a... | 18951792 |
| Unchecked | IC50 | = | 30.0 | nM | 7.52 | Inhibition of 50S ribosomal subunit purified from linezolid-,erythromycin-resist... | 18663023 |
| Unchecked | IC50 | = | 90.0 | nM | 7.05 | Inhibition of 50S ribosomal subunit purified from Staphylococcus aureus ATCC 292... | 18663023 |
| Unchecked | IC50 | = | 17000.0 | nM | 4.77 | Selectivity ratio of IC50 for rabbit reticulocyte 50S ribosomal subunit to IC50 ... | 18663023 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18663023 | 10.1128/aac.01193-07 | Unchecked | 3 |
| 18951792 | 10.1016/j.bmcl.2008.10.014 | Haemophilus influenzae | 2 |
| 18663023 | 10.1128/aac.01193-07 | Staphylococcus aureus | 2 |
| 18663023 | 10.1128/aac.01193-07 | Enterococcus faecalis | 2 |
| 18951792 | 10.1016/j.bmcl.2008.10.014 | Escherichia coli | 1 |
| 18951792 | 10.1016/j.bmcl.2008.10.014 | Streptococcus pneumoniae | 1 |
| 18951792 | 10.1016/j.bmcl.2008.10.014 | Streptococcus pyogenes | 1 |
| 18951792 | 10.1016/j.bmcl.2008.10.014 | Enterococcus faecalis | 1 |
| 18663023 | 10.1128/aac.01193-07 | Enterococcus faecium | 1 |
Data from ChEMBL 36 via Core Engine