KEGG   DRUG: Lersivirine
Entry
D09634                      Drug                                   
Name
Lersivirine (USAN/INN)
Formula
C17H18N4O2
Exact mass
310.143
Mol weight
310.3504
Structure
Class
Antiviral
 DG01889  Non-nucleoside reverse transcriptase inhibitor (NNRTI)
 DG03107  Anti-HIV agent
  DG01656  HIV reverse transcriptase inhibitor
Efficacy
Antiviral
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)
   D09634  Lersivirine
  DG03107  Anti-HIV agent
   DG01656  HIV reverse transcriptase inhibitor
    D09634  Lersivirine
Antimicrobials [BR:br08307]
 Antivirals
  Genome replication inhibitor
   HIV reverse transcriptase inhibitor
    D09634  Lersivirine (USAN/INN)
Other DBs
CAS: 473921-12-9
PubChem: 124490374
ChEBI: 177465
PDB-CCD: ZZE[PDBj]
LigandBox: D09634
LinkDB
KCF data

ATOM        23
            1   C8y C    18.7600  -26.9500
            2   C8x C    18.7600  -28.3500
            3   C8y C    19.9500  -29.0500
            4   C8x C    21.2100  -28.3500
            5   C8y C    21.2100  -26.9500
            6   C8x C    19.9500  -26.2500
            7   O2a O    22.4000  -26.2500
            8   C8y C    23.5900  -26.9500
            9   C8y C    23.5900  -28.3500
            10  N4y N    24.9200  -28.7700
            11  N5x N    25.7600  -27.6500
            12  C8y C    24.9200  -26.5300
            13  C3b C    17.5700  -26.2500
            14  C3b C    19.9500  -30.4500
            15  C1b C    24.9200  -25.1300
            16  C1a C    26.1100  -24.4300
            17  C1b C    22.4000  -29.0500
            18  C1a C    22.4000  -30.4500
            19  C1b C    24.9200  -30.1700
            20  C1b C    26.1324  -30.8700
            21  O1a O    26.1324  -32.2700
            22  N3a N    19.9500  -31.8500
            23  N3a N    16.3576  -25.5500
BOND        24
            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     5   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 1
            12   11  12 2
            13    8  12 1
            14    1  13 1
            15    3  14 1
            16   12  15 1
            17   15  16 1
            18   17   9 1
            19   17  18 1
            20   10  19 1
            21   19  20 1
            22   20  21 1
            23   14  22 3
            24   13  23 3

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