Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: Parent
ATC: J01MA17
UNII: J42298IESW

Structure

InChI Key PWNMXPDKBYZCOO-UHFFFAOYSA-N
Smile Cc1oc(=O)oc1CN1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)c2n3C(C)S2)CC1
InChI
InChI=1S/C21H20FN3O6S/c1-10-16(31-21(29)30-10)9-23-3-5-24(6-4-23)15-8-14-12(7-13(15)22)18(26)17(20(27)28)19-25(14)11(2)32-19/h7-8,11H,3-6,9H2,1-2H3,(H,27,28)

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H20FN3O6S
Molecular Weight 461.47
AlogP 2.64
Hydrogen Bond Acceptor 9.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 109.13
Molecular species ACID
Aromatic Rings 3.0
Heavy Atoms 32.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Bacterial DNA gyrase inhibitor Other PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Bronchitis, Chronic 3 D029481 ClinicalTrials
Urinary Tract Infections 3 D014552 ClinicalTrials
Gastroenteritis 3 D005759 ClinicalTrials
Prostatitis 2 D011472 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 123447-62-1
ChEBI 32071
ChEMBL CHEMBL422648
DrugBank DB11892
DrugCentral 2325
EPA CompTox DTXSID0046480
FDA SRS J42298IESW
PubChem 65947
SureChEMBL SCHEMBL1650794