| Entry |
|
|---|
| Name |
Carvotroline hydrochloride (USAN) |
|---|
| Formula |
C18H18FN3. HCl
|
|---|
| Exact mass |
331.1252
|
|---|
| Mol weight |
331.81
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
|
|---|
| Efficacy |
Antipsychotic, Dopamine D2 receptor antagonist |
|---|
| Target |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
D02645 Carvotroline hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD2
D02645 Carvotroline hydrochloride (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 23
1 X Cl 31.5985 -16.6325
2 C8y C 13.7900 -16.5200
3 C8x C 13.7900 -17.9200
4 C8x C 15.0024 -18.6200
5 C8y C 16.2149 -17.9200
6 C8y C 16.2149 -16.5200
7 C8x C 15.0024 -15.8200
8 N4x N 17.4273 -18.6200
9 C8y C 18.6398 -17.9200
10 C8y C 18.6398 -16.5200
11 C1x C 19.8522 -18.6200
12 C1x C 21.0646 -17.9200
13 N1y N 21.0646 -16.5200
14 C1x C 19.8522 -15.8200
15 X F 12.5776 -15.8200
16 C1b C 22.2824 -15.8200
17 C1b C 23.4949 -16.5200
18 C8y C 24.7073 -15.8200
19 C8x C 25.9218 -16.5212
20 C8x C 27.1342 -15.8212
21 N5x N 27.1342 -14.4212
22 C8x C 25.9197 -13.7200
23 C8x C 24.7073 -14.4200
BOND 25
1 2 3 2
2 3 4 1
3 4 5 2
4 5 6 1
5 6 7 2
6 2 7 1
7 5 8 1
8 8 9 1
9 9 10 2
10 6 10 1
11 9 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 10 14 1
16 2 15 1
17 13 16 1
18 16 17 1
19 17 18 1
20 18 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 2
25 18 23 1
|
|---|
