KEGG   DRUG: Delafloxacin
Entry
D09330                      Drug                                   
Name
Delafloxacin (USAN)
Formula
C18H12ClF3N4O4
Exact mass
440.0499
Mol weight
440.76
Structure
Class
Antibacterial
 DG01550  Quinolone
  DG01549  Fluoroquinolone
Remark
ATC code: J01MA23
Chemical structure group: DG01215
Product (DG01215): D09331<US>
Efficacy
Antibacterial, Nucleic acid biosynthesis inhibitor
Comment
Fluoroquinolones
Target
DNA gyrase [KO:K02469 K02470]
topoisomerase IV [KO:K02621 K02622]
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01M QUINOLONE ANTIBACTERIALS
    J01MA Fluoroquinolones
     J01MA23 Delafloxacin
      D09330  Delafloxacin (USAN)
Drug groups [BR:br08330]
 Antibacterial
  DG01550  Quinolone
   DG01549  Fluoroquinolone
    DG01215  Delafloxacin
     D09330  Delafloxacin
Antimicrobials [BR:br08307]
 Antibacterials
  Nucleic acid synthesis inhibitor
   Fluoroquinolone
    D09330  Delafloxacin (USAN)
Drug groups [BR:br08330]
 Antibacterial
  DG01550  Quinolone
   DG01549  Fluoroquinolone
    DG01215  Delafloxacin
Antimicrobials abbreviations [BR:br08327]
 Antibacterials
  Nucleic acid synthesis inhibitor
   Fluoroquinolone
    DG01215  Delafloxacin
Other DBs
CAS: 189279-58-1
PubChem: 96026010
PDB-CCD: TE9[PDBj]
LigandBox: D09330
LinkDB
KCF data

ATOM        30
            1   C8y C    21.0000  -12.6000
            2   C8y C    21.0000  -11.2000
            3   N4y N    22.1900  -13.3000
            4   C8y C    19.7400  -13.3000
            5   C8y C    22.1900  -10.5000
            6   C8x C    19.7400  -10.5000
            7   C8x C    23.4500  -12.6000
            8   C8y C    22.1900  -14.7000
            9   C8y C    18.5500  -12.6000
            10  C8y C    23.4500  -11.2000
            11  O5x O    22.1900   -9.1000
            12  C8y C    18.5500  -11.2000
            13  N1y N    17.3600  -13.3000
            14  C6a C    24.6400  -10.5000
            15  X   F    17.3600  -10.5000
            16  O6a O    25.9000  -11.2000
            17  O6a O    24.6400   -9.0300
            18  N5x N    21.0000  -15.4000
            19  C8y C    21.0000  -16.8000
            20  C8y C    22.2600  -17.5000
            21  C8x C    23.4500  -16.8000
            22  C8y C    23.4500  -15.4000
            23  X   F    22.2600  -18.9000
            24  X   Cl   19.7400  -14.7000
            25  C1x C    17.0100  -14.6300
            26  C1y C    15.6800  -14.2800
            27  C1x C    16.0300  -12.9500
            28  O1a O    14.4900  -14.9800
            29  N1a N    19.8100  -17.5000
            30  X   F    24.6400  -14.7000
BOND        33
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    5  11 2
            11    6  12 2
            12    9  13 1
            13   10  14 1
            14   12  15 1
            15   14  16 1
            16   14  17 2
            17    7  10 2
            18    9  12 1
            19    8  18 2
            20   18  19 1
            21   19  20 2
            22   20  21 1
            23   21  22 2
            24    8  22 1
            25   20  23 1
            26    4  24 1
            27   13  25 1
            28   25  26 1
            29   26  27 1
            30   13  27 1
            31   26  28 1
            32   19  29 1
            33   22  30 1

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