KEGG   DRUG: Fosdevirine
Entry
D09906                      Drug                                   
Name
Fosdevirine (USAN/INN)
Formula
C20H17ClN3O3P
Exact mass
413.0696
Mol weight
413.794
Structure
Class
Antiviral
 DG01889  Non-nucleoside reverse transcriptase inhibitor (NNRTI)
 DG03107  Anti-HIV agent
  DG01656  HIV reverse transcriptase inhibitor
Efficacy
Antiviral, Reverse transcriptase inhibitor
Target
HIV-1 reverse transcriptase [KO:K24802]
  Pathway
ko03230  Viral genome structure
ko03240  Viral replication
ko03250  Viral life cycle - HIV-1
Interaction
Brite
Drug groups [BR:br08330]
 Antiviral
  DG01889  Non-nucleoside reverse transcriptase inhibitor (NNRTI)
   D09906  Fosdevirine
  DG03107  Anti-HIV agent
   DG01656  HIV reverse transcriptase inhibitor
    D09906  Fosdevirine
Antimicrobials [BR:br08307]
 Antivirals
  Genome replication inhibitor
   HIV reverse transcriptase inhibitor
    D09906  Fosdevirine (USAN/INN)
Other DBs
CAS: 1018450-26-4
PubChem: 135626649
ChEBI: 229854
LigandBox: D09906
LinkDB
KCF data

ATOM        28
            1   C8x C    14.7155  -21.8068
            2   C8y C    14.7155  -23.2095
            3   C8x C    15.9079  -23.9109
            4   C8y C    17.1703  -23.2095
            5   C8y C    17.1703  -21.8068
            6   C8x C    15.9079  -21.1055
            7   C8y C    18.5029  -23.6304
            8   C8y C    19.2744  -22.5082
            9   N4x N    18.5029  -21.3860
            10  P1a P    19.2043  -24.8227
            11  O3b O    20.6070  -24.8227
            12  X   Cl   13.4979  -23.9060
            13  C5a C    20.6771  -22.5082
            14  N1a N    21.3785  -23.7229
            15  O5a O    21.3785  -21.2934
            16  C8y C    18.2817  -26.2791
            17  O2b O    20.1143  -26.2451
            18  C1a C    21.5143  -26.2451
            19  C8x C    16.8817  -26.2791
            20  C8y C    16.1817  -27.4915
            21  C8x C    16.8817  -28.7040
            22  C8y C    18.2817  -28.7040
            23  C8x C    18.9817  -27.4915
            24  C2b C    18.9770  -29.9084
            25  C2b C    20.3699  -29.9083
            26  C3b C    21.0621  -31.1070
            27  N3a N    21.7621  -32.3194
            28  C1a C    14.7701  -27.4913
BOND        30
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    5   9 1
            11   10  11 2
            12   10   7 1
            13    2  12 1
            14    8  13 1
            15   13  14 1
            16   13  15 2
            17   10  16 1 #Up
            18   10  17 1 #Down
            19   17  18 1
            20   16  19 2
            21   19  20 1
            22   20  21 2
            23   21  22 1
            24   22  23 2
            25   16  23 1
            26   22  24 1
            27   24  25 2
            28   25  26 1
            29   26  27 3
            30   20  28 1

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