| Entry |
|
|---|
| Name |
Navacaprant hydrochloride (USAN) |
|---|
| Formula |
C25H32FN5O2. HCl
|
|---|
| Exact mass |
489.2307
|
|---|
| Mol weight |
490.0132
|
|---|
| Structure |
|
|---|
| Class |
Analgesic
DG01586 Opioid receptor antagonist
|
|---|
| Remark |
|
|---|
| Efficacy |
Antidepressant, Opioid receptor antagonist |
|---|
| Comment |
Treatment of major depressive disorder
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Analgesic
DG01586 Opioid receptor antagonist
DG03305 Navacaprant
D12870 Navacaprant hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRK1
D12870 Navacaprant hydrochloride (USAN)
Drug groups [BR:br08330]
Analgesic
DG01586 Opioid receptor antagonist
DG03305 Navacaprant
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 34
1 C8x C 13.0784 -14.8358
2 C8y C 13.0784 -16.2420
3 C8x C 14.2736 -16.9451
4 C8y C 15.5392 -16.2420
5 C8y C 15.5392 -14.8358
6 C8y C 14.2736 -14.1327
7 C8y C 16.7345 -16.9451
8 C8y C 17.9298 -16.2420
9 C8y C 17.9298 -14.8358
10 N5x N 16.7345 -14.1327
11 X F 14.2736 -12.7265
12 C1a C 16.7345 -18.3513
13 C1b C 11.8831 -16.9451
14 C1a C 10.6878 -16.2420
15 N1y N 19.1954 -14.1327
16 C8y C 19.1954 -16.9451
17 C1x C 20.3906 -14.8358
18 C1x C 21.5859 -14.1327
19 C1y C 21.5859 -12.7265
20 C1x C 20.3906 -12.0234
21 C1x C 19.1954 -12.7265
22 N1b N 22.7812 -12.0234
23 C1y C 24.0468 -12.7265
24 C1x C 24.0468 -14.1327
25 C1x C 25.2421 -14.8358
26 O2x O 26.4373 -14.1327
27 C1x C 26.4373 -12.7265
28 C1x C 25.2421 -12.0234
29 N5x N 19.3360 -18.3513
30 C8y C 20.6719 -18.6326
31 N5x N 21.3750 -17.4373
32 O2x O 20.4610 -16.3826
33 C1a C 21.2344 -19.8982
34 X Cl 26.3900 -19.3200
BOND 37
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 2
9 8 9 1
10 9 10 2
11 5 10 1
12 6 11 1
13 7 12 1
14 2 13 1
15 13 14 1
16 9 15 1
17 8 16 1
18 15 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 15 21 1
24 19 22 1
25 22 23 1
26 23 24 1
27 24 25 1
28 25 26 1
29 26 27 1
30 27 28 1
31 23 28 1
32 16 29 2
33 29 30 1
34 30 31 2
35 31 32 1
36 16 32 1
37 30 33 1
|
|---|
