finafloxacin   Click here for help

GtoPdb Ligand ID: 10809

Synonyms: AL-60371 | AL60371 | Xtoro®
Compound class: Synthetic organic
Comment: Finafloxacin is a fluoroquinolone antibacterial.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 107.59
Molecular weight 398.14
XLogP 3.24
No. Lipinski's rules broken 0
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Canonical SMILES N#Cc1c(N2C[C@H]3[C@H](C2)NCCO3)c(F)cc2c1n(cc(c2=O)C(=O)O)C1CC1
Isomeric SMILES N#Cc1c(N2C[C@H]3[C@H](C2)NCCO3)c(F)cc2c1n(cc(c2=O)C(=O)O)C1CC1
InChI InChI=1S/C20H19FN4O4/c21-14-5-11-17(25(10-1-2-10)7-13(19(11)26)20(27)28)12(6-22)18(14)24-8-15-16(9-24)29-4-3-23-15/h5,7,10,15-16,23H,1-4,8-9H2,(H,27,28)/t15-,16-/m0/s1
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
7-[(4aS,7aS)-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b][1,4]oxazin-6-yl]-8-cyano-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
International Nonproprietary Names Click here for help
INN number INN
8121 finafloxacin
Synonyms Click here for help
AL-60371 | AL60371 | Xtoro®
Database Links Click here for help
Specialist databases
Antibiotic DB Antibiotic DB Database logo Finafloxacin
Other databases
CAS Registry No. 209342-40-5 (source: WHO INN record)
ChEMBL Ligand CHEMBL1908370
DrugCentral Ligand 4920
GtoPdb PubChem SID 405560250
PubChem CID 11567473
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UniChem Compound Search for chemical match using the InChIKey FYMHQCNFKNMJAV-HOTGVXAUSA-N
UniChem Connectivity Search for chemical match using the InChIKey FYMHQCNFKNMJAV-HOTGVXAUSA-N