rosoxacin   Click here for help

GtoPdb Ligand ID: 12474

Synonyms: acrosoxacin | Eracine® | Eradacil® | Eradacin® | WIN 35213 | Winuron®
Approved drug
rosoxacin is an approved drug
Compound class: Synthetic organic
Comment: Rosoxacin is a quinolone antibacterial compound with activity against Gram-negative bacteria.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 69.97
Molecular weight 294.31
XLogP 1.44
No. Lipinski's rules broken 0
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Canonical SMILES CCN1C=C(C(=O)C2=CC=C(C=C21)C3=CC=NC=C3)C(=O)O
Isomeric SMILES CCN1C=C(C(=O)C2=C1C=C(C=C2)C3=CC=NC=C3)C(=O)O
InChI InChI=1S/C17H14N2O3/c1-2-19-10-14(17(21)22)16(20)13-4-3-12(9-15(13)19)11-5-7-18-8-6-11/h3-10H,2H2,1H3,(H,21,22)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes
Withdrawn drug? Yes
IUPAC Name Click here for help
1-ethyl-4-oxo-7-pyridin-4-ylquinoline-3-carboxylic acid
International Nonproprietary Names Click here for help
INN number INN
3903 rosoxacin
Synonyms Click here for help
acrosoxacin | Eracine® | Eradacil® | Eradacin® | WIN 35213 | Winuron®
Database Links Click here for help
Specialist databases
Antibiotic DB Antibiotic DB Database logo Rosoxacin
Other databases
CAS Registry No. 40034-42-2 (source: Scifinder)
ChEBI CHEBI:131715
ChEMBL Ligand CHEMBL291157
DrugBank Ligand DB00817
DrugCentral Ligand 83
GtoPdb PubChem SID 479821264
PubChem CID 287180
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UniChem Compound Search for chemical match using the InChIKey XBPZXDSZHPDXQU-UHFFFAOYSA-N
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