Sisunatovir


Entry
D12200                      Drug                                   
Name
Sisunatovir (USAN/INN)
Formula
C23H22F4N4O
Exact mass
446.173
Mol weight
446.4406
Structure
Remark
Chemical structure group: DG03171
Efficacy
Antiviral, Fusion protein inhibitor
Comment
Treatment of respiratory syncytial virus infection
Target
RSV F protein [KO:K19261]
Brite
Antimicrobials [BR:br08307]
 Antivirals
  Entry, fusion or uncoating inhibitor
   RSV F protein
    D12200  Sisunatovir (USAN/INN)
Other DBs
CAS: 1903763-82-5
PDB-CCD: WVA[PDBj]
KCF data

ATOM        32
            1   C8x C     9.4500  -15.8200
            2   C8y C     9.4500  -17.2200
            3   C8x C    10.6400  -17.9200
            4   C8y C    11.9000  -17.2200
            5   C8y C    11.9000  -15.8200
            6   C8x C    10.6400  -15.1200
            7   N5x N    13.2300  -17.6400
            8   C8y C    14.0000  -16.5200
            9   N4y N    13.2300  -15.4000
            10  C1b C     8.2600  -17.9200
            11  N1a N     7.0700  -17.2200
            12  C1b C    13.6500  -14.0700
            13  C1b C    15.0500  -13.7900
            14  C1b C    15.9600  -14.8400
            15  C1b C    15.4000  -16.5200
            16  C1d C    17.3600  -14.5600
            17  N1y N    16.1000  -17.7100
            18  C5x C    15.6800  -19.0400
            19  C1z C    16.8000  -19.8800
            20  C8y C    17.9200  -19.1100
            21  C8y C    17.5000  -17.7100
            22  C8x C    19.2500  -19.3900
            23  C8x C    20.2300  -18.3400
            24  C8y C    19.7400  -17.0100
            25  C8x C    18.4100  -16.7300
            26  O5x O    14.3500  -19.3900
            27  C1x C    16.1000  -21.0700
            28  C1x C    17.5000  -21.0700
            29  X   F    20.6554  -15.9507
            30  X   F    18.7123  -14.1977
            31  X   F    16.9977  -13.2077
            32  X   F    17.7223  -15.9123
BOND        36
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    5   9 1
            11    2  10 1
            12   10  11 1
            13    9  12 1
            14   12  13 1
            15   13  14 1
            16    8  15 1
            17   14  16 1
            18   15  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23   17  21 1
            24   20  22 2
            25   22  23 1
            26   23  24 2
            27   24  25 1
            28   21  25 2
            29   18  26 2
            30   27  28 1
            31   28  19 1
            32   19  27 1
            33   24  29 1
            34   16  30 1
            35   16  31 1
            36   16  32 1