CINOXACIN

Search structure
Trade Names:
Synonyms:
Status: Approved (1980)
Entry Type: Small molecule
Molecule Category: Parent
ATC: J01MB06
UNII: LMK22VUH23

Structure
InChI Key VDUWPHTZYNWKRN-UHFFFAOYSA-N
Smile CCn1nc(C(=O)O)c(=O)c2cc3c(cc21)OCO3
InChI
InChI=1S/C12H10N2O5/c1-2-14-7-4-9-8(18-5-19-9)3-6(7)11(15)10(13-14)12(16)17/h3-4H,2,5H2,1H3,(H,16,17)

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H10N2O5
Molecular Weight 262.22
AlogP 0.84
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 90.65
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 19.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Bacterial DNA gyrase inhibitor FDA ISBN
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- - - - 3
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 102

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Osteomyelitis 0 D010019 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 28657-80-9
ChEBI 3716
ChEMBL CHEMBL1208
DrugBank DB00827
DrugCentral 657
EPA CompTox DTXSID8022822
FDA SRS LMK22VUH23
Human Metabolome Database HMDB0014965
KEGG C08052
PharmGKB PA449007
PubChem 2762
SureChEMBL SCHEMBL43770
ZINC ZINC000000032350
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