Compound Detail
CHEMBL560671
PLATENSIMYCIN Enter ChEMBL ID:
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CC12C[C@@]34C=CC(=O)[C@@](C)(CCC(=O)Nc5c(O)ccc(C(=O)O)c5O)C3[C@H](CC1C4)O2
Basic Information
| ChEMBL ID | CHEMBL560671 |
| Name | PLATENSIMYCIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CSOMAHTTWTVBFL-RRSCQWGLSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
441.5
MW (Da)
3.23
ALogP
6
HBA
4
HBD
133.2
PSA (Ų)
0.52
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 7.72 | 6.1433 | 19.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 19.0 | nM | 7.72 | Inhibition of Escherichia coli FabF C163F | 19581087 |
| Unchecked | IC50 | = | 290.0 | nM | 6.54 | Inhibition of Staphylococcus aureus FabF assessed as reduced accumulation of lon... | 17456595 |
| Unchecked | IC50 | = | 67000.0 | nM | 4.17 | Inhibition of Staphylococcus aureus FabH by direct binding assay | 17456595 |
Literature References
Data from ChEMBL 36 via Core Engine