Entry |
|
Name |
Sonepiprazole mesylate (USAN) |
Formula |
C21H27N3O3S. CH4SO3
|
Exact mass |
497.1654
|
Mol weight |
497.63
|
Structure |

|
Class |
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01476 Dopamine D4-receptor antagonist
|
Efficacy |
Antipsychotic, Dopamine D4 receptor antagonist |
Target |
|
Pathway |
hsa04080 | Neuroactive ligand-receptor interaction |
|
Interaction |
|
Brite |
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01476 Dopamine D4-receptor antagonist
D05891 Sonepiprazole mesylate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD4
D05891 Sonepiprazole mesylate (USAN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 33
1 C1y C 26.5300 -23.0300
2 O2x O 26.5300 -24.4300
3 C1x C 27.7200 -25.1300
4 C1x C 28.9100 -24.4300
5 C8y C 28.9100 -23.0300
6 C8y C 27.7200 -22.3300
7 C8x C 30.1700 -22.3300
8 C8x C 30.1700 -20.9300
9 C8x C 28.9100 -20.2300
10 C8x C 27.7200 -20.9300
11 C8y C 16.8000 -18.8300
12 C8x C 16.8000 -20.2300
13 C8x C 17.9900 -20.9300
14 C8y C 19.2500 -20.2300
15 C8x C 19.2500 -18.8300
16 C8x C 17.9900 -18.1300
17 S4a S 15.6100 -18.1300
18 N1a N 14.3500 -17.4300
19 O1d O 16.3100 -16.9400
20 O1d O 14.9100 -19.3200
21 N1y N 20.4400 -20.9300
22 C1x C 20.4400 -22.3300
23 C1x C 21.7000 -23.0300
24 N1y N 22.8900 -22.3300
25 C1x C 22.8900 -20.9300
26 C1x C 21.7000 -20.2300
27 C1b C 24.1500 -23.0300
28 C1b C 25.3400 -22.3300
29 O1d O 34.5800 -20.7900
30 S4a S 34.5800 -22.1900
31 C1a C 33.1800 -22.1900
32 O1d O 35.9800 -22.1900
33 O1d O 34.5800 -23.5900
BOND 35
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 5 7 2
8 7 8 1
9 8 9 2
10 9 10 1
11 6 10 2
12 11 12 2
13 12 13 1
14 13 14 2
15 14 15 1
16 15 16 2
17 11 16 1
18 11 17 1
19 17 18 1
20 17 19 2
21 17 20 2
22 14 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 25 26 1
28 21 26 1
29 24 27 1
30 27 28 1
31 1 28 1 #Up
32 29 30 2
33 30 31 1
34 30 32 1
35 30 33 2
|