| Entry |
|
|---|
| Name |
Branaplam (USAN/INN) |
|---|
| Formula |
C22H27N5O2
|
|---|
| Exact mass |
393.2165
|
|---|
| Mol weight |
393.4821
|
|---|
| Structure |
|
|---|
| Remark |
|
|---|
| Efficacy |
Protein modulator |
|---|
| Target |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Not elsewhere classified
Signaling molecules
Spliceosome
SMN2
D12272 Branaplam (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 29
1 C8x C 5.9500 -15.1200
2 C8y C 5.9500 -16.5200
3 C8x C 7.1624 -17.2200
4 C8y C 8.3749 -16.5200
5 C8y C 8.3749 -15.1200
6 C8x C 7.1624 -14.4200
7 C8y C 9.6060 -14.4090
8 N5x N 10.8112 -15.1047
9 N5x N 12.0235 -14.4046
10 C8y C 12.0235 -13.0046
11 C8x C 10.8183 -12.3089
12 C8x C 9.6059 -13.0090
13 O2a O 13.2414 -12.3012
14 C1y C 14.4534 -13.0007
15 C1x C 14.4540 -14.4196
16 C1z C 15.6667 -15.1190
17 N1x N 16.8789 -14.4185
18 C1z C 16.8782 -12.9996
19 C1x C 15.6655 -12.3002
20 C1a C 14.9667 -16.3315
21 C1a C 16.3667 -16.3315
22 C1a C 17.5782 -11.7872
23 C1a C 18.2782 -12.9996
24 C8y C 4.7376 -17.2200
25 C8x C 3.4774 -16.6588
26 N4x N 2.5543 -17.6839
27 N5x N 3.2439 -18.8786
28 C8x C 4.5932 -18.5919
29 O1a O 9.6060 -17.2310
BOND 32
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 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 7 12 1
14 10 13 1
15 13 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 14 19 1
22 16 20 1
23 16 21 1
24 18 22 1
25 18 23 1
26 2 24 1
27 24 25 2
28 25 26 1
29 26 27 1
30 27 28 2
31 24 28 1
32 4 29 1
|
|---|
