Entry |
|
Name |
Baloxavir (USAN) |
Formula |
C24H19F2N3O4S
|
Exact mass |
483.1064
|
Mol weight |
483.4872
|
Structure |
|
Simcomp |
|
Class |
Antiviral
DG03029 Anti-influenza virus agent
|
Remark |
Product (DG02962): | D11021<JP/US> |
|
Efficacy |
Antiviral |
Comment |
Antiviral for the treatment of influenza A and B
|
Target |
Influenza A virus polymerase acidic protein [KO: K19390] |
Pathway |
|
Interaction |
|
Brite |
Drug groups [BR:br08330]
Antiviral
DG03029 Anti-influenza virus agent
DG02962 Baloxavir
D11278 Baloxavir
Antimicrobials [BR:br08307]
Antivirals
Genome replication inhibitor
Other inhibitor
D11278 Baloxavir (USAN)
Drug groups [BR:br08330]
Antiviral
DG03029 Anti-influenza virus agent
DG02962 Baloxavir
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 34
1 N1y N 17.0964 -16.8162
2 N4y N 18.2876 -16.1155
3 C8y C 18.2876 -14.7142
4 C5x C 17.0964 -14.0135
5 N1y N 15.9053 -14.7142
6 C1y C 15.9053 -16.1155
7 C8x C 19.5488 -16.8162
8 C8x C 20.7400 -16.1155
9 C8y C 20.7400 -14.7142
10 C8y C 19.5488 -14.0135
11 C1x C 14.7142 -14.0135
12 C1x C 13.4529 -14.7142
13 O2x O 13.4529 -16.1155
14 C1x C 14.7142 -16.8162
15 O5x O 17.0964 -12.6121
16 O5x O 21.9311 -14.0135
17 O1a O 19.5488 -12.6121
18 C1x C 16.3958 -21.3706
19 C8y C 15.5550 -20.2495
20 C8y C 15.8352 -18.8481
21 C1y C 17.0964 -18.2876
22 S2x S 17.7971 -21.3706
23 C8y C 18.3577 -18.9182
24 C8y C 18.7080 -20.3195
25 C8x C 14.8543 -17.8672
26 C8x C 13.5230 -18.2876
27 C8y C 13.1727 -19.6189
28 C8y C 14.1536 -20.5998
29 C8x C 20.0393 -20.7400
30 C8x C 21.0903 -19.7590
31 C8x C 20.7400 -18.4277
32 C8x C 19.4087 -18.0073
33 X F 13.8033 -21.9311
34 X F 11.8414 -19.9692
BOND 39
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 2 7 1
8 7 8 2
9 8 9 1
10 9 10 1
11 3 10 2
12 5 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 6 14 1
17 4 15 2
18 9 16 2
19 10 17 1
20 20 21 1
21 18 22 1
22 21 23 1
23 19 20 1
24 22 24 1
25 18 19 1
26 23 24 1
27 20 25 2
28 25 26 1
29 26 27 2
30 27 28 1
31 19 28 2
32 24 29 2
33 29 30 1
34 30 31 2
35 31 32 1
36 23 32 2
37 28 33 1
38 27 34 1
39 21 1 1 #Down
|