| Entry |
|
|---|
| Name |
Filorexant (USAN/INN) |
|---|
| Formula |
C24H25FN4O2
|
|---|
| Exact mass |
420.1962
|
|---|
| Mol weight |
420.4793
|
|---|
| Structure |
|
|---|
| Class |
Neuropsychiatric agent
DG03225 Orexin receptor antagonist
|
|---|
| Efficacy |
Hypnotic, Orexin receptor antagonist |
|---|
| Comment |
Treatment of insomnia
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Neuropsychiatric agent
DG03225 Orexin receptor antagonist
D10345 Filorexant
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Orexin
HCRTR
D10345 Filorexant (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 31
1 C8y C 12.5926 -14.7592
2 C8x C 12.5926 -16.1584
3 C8x C 13.8043 -16.8580
4 C8y C 15.0160 -16.1584
5 N5x N 15.0160 -14.7592
6 C8x C 13.8043 -14.0596
7 O2a O 16.2464 -16.8690
8 C1b C 17.4509 -16.1737
9 C1y C 18.6325 -16.8561
10 C1x C 18.6324 -18.2569
11 C1x C 19.8441 -18.9566
12 C1y C 21.0559 -18.2571
13 N1y N 21.0560 -16.8563
14 C1x C 19.8443 -16.1566
15 C5a C 22.2682 -16.1566
16 C8y C 23.4645 -16.8476
17 C8x C 23.4644 -18.2568
18 C8y C 24.6761 -18.9565
19 C8x C 25.8879 -18.2569
20 C8x C 25.8880 -16.8477
21 C8y C 24.6763 -16.1480
22 C8y C 24.6765 -14.7593
23 N5x N 25.9025 -14.0516
24 C8x C 25.9026 -12.6525
25 C8x C 24.6909 -11.9528
26 C8x C 23.4649 -12.6605
27 N5x N 23.4648 -14.0596
28 X F 11.3809 -14.0596
29 O5a O 22.2683 -14.7594
30 C1a C 24.6761 -20.3558
31 C1a C 22.2687 -18.9576
BOND 34
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 4 7 1
8 7 8 1
9 9 8 1 #Up
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 9 14 1
16 13 15 1
17 15 16 1
18 16 17 2
19 17 18 1
20 18 19 2
21 19 20 1
22 20 21 2
23 16 21 1
24 21 22 1
25 22 23 2
26 23 24 1
27 24 25 2
28 25 26 1
29 26 27 2
30 22 27 1
31 1 28 1
32 15 29 2
33 18 30 1
34 12 31 1 #Down
|
|---|
