| Entry |
|
|---|
| Name |
Tandospirone (INN) |
|---|
| Formula |
C21H29N5O2
|
|---|
| Exact mass |
383.2321
|
|---|
| Mol weight |
383.4873
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01483 5-HT1A-receptor agonist
|
|---|
| Remark |
| Product (DG01306): | D01992<JP> |
|
|---|
| Efficacy |
Antianxiety, Tranquilizer, Serotonin 5-HT1A receptor agonist |
|---|
| Comment |
Busupirone derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07211 | Serotonin receptor agonists/antagonists |
|
|---|
| Brite |
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01483 5-HT1A-receptor agonist
DG01306 Tandospirone
D08561 Tandospirone
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Serotonin
HTR1A
D08561 Tandospirone (INN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01483 5-HT1A-receptor agonist
DG01306 Tandospirone
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 28
1 C1b C 23.9400 -16.8700
2 C1b C 22.7500 -16.1700
3 C1b C 21.5600 -16.8700
4 C1b C 20.3700 -16.1700
5 N1y N 19.1100 -16.8700
6 C1x C 19.1100 -18.2700
7 C1x C 17.9200 -18.9000
8 N1y N 16.7300 -18.2700
9 C1x C 16.7300 -16.8700
10 C1x C 17.9200 -16.1700
11 C8y C 15.5400 -18.9000
12 N5x N 15.5400 -20.3000
13 C8x C 14.3500 -21.0000
14 C8x C 13.0900 -20.3000
15 C8x C 13.0900 -18.9000
16 N5x N 14.3500 -18.2700
17 C1x C 29.8200 -15.3300
18 C1x C 29.8900 -16.7300
19 C1y C 28.6300 -17.5000
20 C1y C 27.4400 -16.8000
21 C1y C 27.4400 -15.4000
22 C1y C 28.6300 -14.7000
23 C5x C 26.1100 -17.2200
24 N1y N 25.2700 -16.1000
25 C5x C 26.1100 -14.9100
26 O5x O 25.6900 -13.5800
27 O5x O 25.7600 -18.4800
28 C1x C 28.2100 -16.0300
BOND 32
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 5 10 1
11 8 11 1
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 17 18 1
19 18 19 1
20 19 20 1
21 20 21 1
22 21 22 1
23 17 22 1
24 23 24 1
25 24 25 1
26 21 25 1
27 25 26 2
28 23 27 2
29 22 28 1 #Down
30 19 28 1 #Down
31 20 23 1
32 1 24 1
|
|---|
