| Entry |
|
|---|
| Name |
Vabicaserin hydrochloride (USAN);
SCA 136 |
|---|
| Formula |
C15H20N2. HCl
|
|---|
| Exact mass |
264.1393
|
|---|
| Mol weight |
264.79
|
|---|
| Structure |
|
|---|
| Efficacy |
Antipsychotic, Serotonin receptor agonist |
|---|
| Comment |
Treatment of schizophrenia
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Serotonin
HTR2C
D06660 Vabicaserin hydrochloride (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 18
1 C1x C 31.5634 -17.2994
2 C1x C 30.7213 -16.1898
3 N1y N 31.0565 -14.8330
4 C8y C 32.3175 -14.2549
5 N1x N 32.9692 -17.3246
6 C8y C 33.5711 -14.8772
7 C1x C 33.8576 -16.2459
8 C8y C 32.3392 -12.8800
9 C8x C 33.5631 -12.1988
10 C1y C 31.1385 -12.1614
11 C1y C 29.9162 -12.8416
12 C8x C 34.7317 -12.8983
13 C8x C 34.7317 -14.2983
14 C1x C 29.9162 -14.2416
15 C1x C 30.8692 -10.7887
16 C1x C 29.4805 -10.6206
17 C1x C 28.8915 -11.8894
18 X Cl 37.1700 -15.5400
BOND 20
1 3 4 1
2 1 5 1
3 4 6 1
4 2 3 1
5 5 7 1
6 1 2 1
7 6 7 1
8 4 8 2
9 8 9 1
10 8 10 1
11 10 11 1
12 9 12 2
13 12 13 1
14 13 6 2
15 11 14 1
16 14 3 1
17 10 15 1
18 15 16 1
19 16 17 1
20 11 17 1
|
|---|
