Entry |
|
Name |
Atevirdine mesylate (USAN) |
Formula |
C21H25N5O2. CH4SO3
|
Exact mass |
475.1889
|
Mol weight |
475.5612
|
Structure |
|
Simcomp |
|
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 |
|
Interaction |
|
Brite |
Drug groups [BR:br08330]
Antiviral
DG01889 Non-nucleoside reverse transcriptase inhibitor (NNRTI)
D03001 Atevirdine mesylate
DG03107 Anti-HIV agent
DG01656 HIV reverse transcriptase inhibitor
D03001 Atevirdine mesylate
Antimicrobials [BR:br08307]
Antivirals
Genome replication inhibitor
HIV reverse transcriptase inhibitor
D03001 Atevirdine mesylate (USAN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 33
1 C5a C 17.3276 -18.0504
2 O5a O 17.3276 -19.4445
3 N1y N 13.7026 -15.9590
4 C1x C 13.7026 -17.3532
5 C1x C 14.8877 -18.0504
6 N1y N 16.1425 -17.3532
7 C1x C 16.1425 -15.9590
8 C1x C 14.8877 -15.2619
9 C8y C 12.4924 -15.2668
10 N5x N 12.4866 -13.8681
11 C8x C 11.2764 -13.1760
12 C8x C 10.0020 -13.8781
13 C8x C 10.0078 -15.2768
14 C8y C 11.2879 -15.9689
15 N1b N 11.2934 -17.3529
16 C1b C 10.0661 -18.0682
17 C1a C 8.8571 -17.3768
18 C8y C 18.5501 -17.3513
19 C8x C 18.5501 -15.9528
20 N4x N 19.8801 -17.7834
21 C8y C 20.7022 -16.6520
22 C8y C 19.8801 -15.5206
23 C8x C 22.0930 -16.6457
24 C8x C 22.6618 -15.2982
25 C8y C 21.8397 -14.2367
26 C8x C 20.4489 -14.2430
27 O2a O 22.4357 -13.0134
28 C1a C 23.8324 -12.9849
29 O1d O 26.9834 -16.6264
30 S4a S 26.9834 -18.0240
31 C1a C 25.5858 -18.0240
32 O1d O 28.3811 -18.0240
33 O1d O 26.9834 -19.4216
BOND 35
1 1 2 2
2 3 4 1
3 4 5 1
4 5 6 1
5 6 7 1
6 7 8 1
7 3 8 1
8 6 1 1
9 3 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 9 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 1 18 1
20 18 19 2
21 18 20 1
22 20 21 1
23 21 22 1
24 19 22 1
25 21 23 2
26 23 24 1
27 24 25 2
28 25 26 1
29 22 26 2
30 25 27 1
31 27 28 1
32 29 30 2
33 30 31 1
34 30 32 1
35 30 33 2
|