| Entry |
|
|---|
| Name |
Sovaprevir (USAN) |
|---|
| Formula |
C43H53N5O8S
|
|---|
| Exact mass |
799.3615
|
|---|
| Mol weight |
799.98
|
|---|
| Structure |
|
|---|
| Class |
Antiviral
DG03198 Anti-HCV agent
DG02001 HCV NS3/4A protease inhibitor
|
|---|
| Efficacy |
Antiviral, Protease inhibitor |
|---|
| Comment |
Peptidomimetics
Treatment of hepatitis C
|
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antiviral
DG03198 Anti-HCV agent
DG02001 HCV NS3/4A protease inhibitor
D10166 Sovaprevir
Antimicrobials [BR:br08307]
Antivirals
Polyprotein cleavage inhibitor
HCV NS3/4A inhibitor
D10166 Sovaprevir (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 57
1 O2a O 20.0200 -23.3800
2 C1y C 21.1400 -22.6800
3 C1x C 22.4700 -23.1000
4 C1y C 23.2400 -21.9800
5 N1y N 22.4000 -20.8600
6 C1x C 21.1400 -21.3500
7 C5a C 24.6400 -21.9100
8 O5a O 25.3400 -23.1000
9 N1b N 25.3400 -20.7200
10 C1z C 27.5100 -20.7200
11 C5a C 22.4000 -19.4600
12 O5a O 23.5900 -18.7600
13 C1c C 21.2100 -18.7600
14 C1b C 20.0900 -19.4600
15 C5a C 18.9000 -18.7600
16 O5a O 18.9000 -17.3600
17 C1d C 21.2100 -17.3600
18 C1a C 20.0900 -16.6600
19 C1a C 22.4000 -16.6600
20 C1a C 21.2100 -16.0300
21 C1x C 28.7700 -21.4900
22 C1y C 28.7700 -20.0900
23 C5a C 27.5100 -22.1200
24 O5a O 28.7000 -22.8200
25 N1b N 26.3200 -22.8200
26 S4a S 26.3200 -24.2200
27 O3c O 27.7200 -24.2200
28 O3c O 24.9200 -24.2200
29 C1y C 26.3200 -25.6200
30 C1x C 25.6200 -26.8100
31 C1x C 27.0200 -26.8100
32 C2b C 29.5060 -18.8991
33 C2a C 30.9060 -18.8991
34 N1y N 17.6847 -19.4551
35 C1x C 16.4963 -18.7623
36 C1x C 15.2809 -19.4572
37 C1x C 15.2751 -20.8572
38 C1x C 16.4636 -21.5500
39 C1x C 17.6789 -20.8551
40 C8y C 20.0200 -24.7800
41 C8y C 18.8076 -25.4800
42 C8y C 18.8076 -26.8800
43 N5x N 20.0200 -27.5800
44 C8y C 21.2324 -26.8800
45 C8x C 21.2324 -25.4800
46 C8x C 17.5951 -24.7800
47 C8x C 16.3827 -25.4800
48 C8y C 16.3827 -26.8800
49 C8x C 17.5951 -27.5800
50 C8y C 22.4279 -27.5704
51 C8x C 22.4280 -28.9797
52 C8x C 23.6404 -29.6797
53 C8x C 24.8528 -28.9797
54 C8x C 24.8528 -27.5703
55 C8x C 23.6404 -26.8704
56 O2a O 15.1682 -27.5812
57 C1a C 13.9717 -26.8902
BOND 63
1 2 1 1 #Up
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 2 6 1
7 4 7 1 #Down
8 7 8 2
9 7 9 1
10 9 10 1
11 5 11 1
12 11 12 2
13 13 11 1 #Up
14 13 14 1
15 14 15 1
16 15 16 2
17 13 17 1
18 17 18 1
19 17 19 1
20 17 20 1
21 10 21 1
22 21 22 1
23 22 10 1
24 10 23 1 #Down
25 23 24 2
26 23 25 1
27 25 26 1
28 26 27 2
29 26 28 2
30 26 29 1
31 30 31 1
32 31 29 1
33 29 30 1
34 22 32 1 #Down
35 32 33 2
36 15 34 1
37 34 35 1
38 35 36 1
39 36 37 1
40 37 38 1
41 38 39 1
42 34 39 1
43 1 40 1
44 40 41 2
45 41 42 1
46 42 43 2
47 43 44 1
48 44 45 2
49 40 45 1
50 41 46 1
51 46 47 2
52 47 48 1
53 48 49 2
54 42 49 1
55 44 50 1
56 50 51 2
57 51 52 1
58 52 53 2
59 53 54 1
60 54 55 2
61 50 55 1
62 48 56 1
63 56 57 1
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