Trade Names: | |
Synonyms: | |
Status: | Approved (1985) |
Entry Type: | Small molecule |
Molecule Category: | Parent |
ATC: | J01DD02 |
UNII: | DZR1ENT301 |
InChI Key | ORFOPKXBNMVMKC-DWVKKRMSSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C22H22N6O7S2 |
Molecular Weight | 546.59 |
AlogP | -1.3 |
Hydrogen Bond Acceptor | 11.0 |
Hydrogen Bond Donor | 3.0 |
Number of Rotational Bond | 9.0 |
Polar Surface Area | 191.22 |
Molecular species | ACID |
Aromatic Rings | 2.0 |
Heavy Atoms | 37.0 |
Action | Mechanism of Action | Reference |
---|---|---|
INHIBITOR | Bacterial penicillin-binding protein inhibitor | PubMed |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Unclassified protein
|
- | - | - | - | 100 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Pneumonia | 4 | D011014 | ClinicalTrials |
Bacterial Infections | 4 | D001424 | ClinicalTrials |
Staphylococcal Skin Infections | 3 | D013207 | ClinicalTrials |
Enterobacteriaceae Infections | 3 | D004756 | ClinicalTrials |
Skin Diseases | 3 | D012871 | ClinicalTrials |
Esophageal Achalasia | 2 | D004931 | ClinicalTrials |
Meningitis, Bacterial | 2 | D016920 | ClinicalTrials |
Cystic Fibrosis | 1 | D003550 | ClinicalTrials |
Osteomyelitis | 0 | D010019 | ClinicalTrials |
Side effects | Relative Frequency (%) | Labels | |
---|---|---|---|
Blood and lymphatic system disorders Eosinophilia | 3.4 |
Resources | Reference |
---|---|
CAS NUMBER | 72558-82-8 |
ChEBI | 3508 |
ChEMBL | CHEMBL44354 |
DrugBank | DB00438 |
EPA CompTox | DTXSID5022770 |
FDA SRS | DZR1ENT301 |
Human Metabolome Database | HMDB0014582 |
Guide to Pharmacology | 10762 |
KEGG | C06889 |
PharmGKB | PA448861 |
PubChem | 6536864 |
SureChEMBL | SCHEMBL36849 |
ZINC | ZINC03871960 |