| Entry |
|
|---|
| Name |
Lubazodone hydrochloride (USAN) |
|---|
| Formula |
C14H18FNO2. HCl
|
|---|
| Exact mass |
287.1088
|
|---|
| Mol weight |
287.76
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Efficacy |
Antidepressant |
|---|
| Comment |
selective serotonine (5-HT) reuptake inhibitor and 5-HT2A antagonist
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Serotonin
HTR2A
D04788 Lubazodone hydrochloride (USAN)
Transporters
Solute carrier family
SLC6
SLC6A4 (HTT)
D04788 Lubazodone hydrochloride (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 19
1 C1y C 40.9536 -28.1100
2 O2x O 39.7219 -28.8216
3 C1x C 39.7223 -30.2197
4 C1x C 40.9332 -30.9184
5 N1x N 42.1650 -30.2068
6 C1x C 42.1645 -28.8087
7 C8x C 38.5487 -22.5180
8 C8x C 38.5487 -23.9161
9 C8y C 39.7594 -24.6151
10 C8y C 40.9703 -23.9161
11 C8y C 40.9703 -22.5180
12 C8y C 39.7594 -21.8190
13 C1x C 42.2999 -24.3481
14 C1x C 43.1217 -23.2171
15 C1x C 42.2999 -22.0860
16 O2a O 39.7594 -26.0130
17 X F 39.7594 -20.4211
18 C1b C 40.9534 -26.7025
19 X Cl 44.7701 -26.9919
BOND 20
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 7 8 2
8 8 9 1
9 9 10 2
10 10 11 1
11 11 12 2
12 7 12 1
13 10 13 1
14 13 14 1
15 14 15 1
16 11 15 1
17 9 16 1
18 12 17 1
19 16 18 1
20 1 18 1 #Down
|
|---|
