| Entry |
|
|---|
| Name |
Atiprosin maleate (USAN) |
|---|
| Formula |
C20H29N3. C4H4O4
|
|---|
| Exact mass |
427.2471
|
|---|
| Mol weight |
427.54
|
|---|
| Structure |
|
|---|
| Efficacy |
Antihypertensive |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Serotonin
HTR2A
D03005 Atiprosin maleate (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 31
1 C8x C 4.2000 -18.5500
2 C8x C 4.2000 -19.9500
3 C8x C 5.3900 -20.6500
4 C8y C 6.6500 -19.9500
5 C8y C 6.6500 -18.5500
6 C8x C 5.3900 -17.8500
7 N4y N 7.9800 -20.3700
8 C8y C 8.8200 -19.2500
9 C8y C 7.9800 -18.1300
10 C1x C 8.5400 -21.7000
11 C1x C 9.9400 -21.8400
12 C1y C 10.7800 -20.7200
13 C1y C 10.1500 -19.3900
14 N1y N 12.1800 -20.8600
15 C1x C 12.9500 -19.6700
16 C1x C 12.3900 -18.4100
17 N1y N 10.9900 -18.2700
18 C1a C 8.4000 -16.8000
19 C1b C 10.4300 -17.0100
20 C1a C 11.2700 -15.8900
21 C1c C 12.6700 -22.0500
22 C1a C 14.0700 -22.2600
23 C1a C 11.9000 -23.2400
24 O6a O 16.2400 -19.1100
25 C6a C 17.6400 -19.1100
26 O6a O 18.3400 -20.3000
27 C2b C 18.3400 -17.9200
28 C2b C 19.9500 -17.9200
29 C6a C 20.6500 -19.1100
30 O6a O 21.9800 -19.1100
31 O6a O 19.9500 -20.3000
BOND 33
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 8 9 2
10 5 9 1
11 7 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 8 13 1
16 12 14 1
17 14 15 1
18 15 16 1
19 16 17 1
20 13 17 1
21 9 18 1
22 17 19 1
23 19 20 1
24 14 21 1
25 21 22 1
26 21 23 1
27 24 25 1
28 25 26 2
29 25 27 1
30 27 28 2
31 28 29 1
32 29 30 2
33 29 31 1
|
|---|
