| Entry |
|
|---|
| Name |
Tofenacin hydrochloride (USAN) |
|---|
| Formula |
C17H21NO. HCl
|
|---|
| Exact mass |
291.1390
|
|---|
| Mol weight |
291.81
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Efficacy |
Antidepressant |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM
D06175 Tofenacin hydrochloride (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 20
1 X Cl 30.5200 -20.5800
2 C1a C 18.6200 -20.2300
3 N1b N 19.8324 -19.5300
4 C1b C 21.0449 -20.2300
5 C1b C 22.2573 -19.5300
6 O2a O 23.4697 -20.2300
7 C1c C 24.6822 -19.5300
8 C8y C 25.8946 -20.2300
9 C8y C 27.1070 -19.5300
10 C8y C 24.6822 -18.1303
11 C8x C 25.9154 -17.4180
12 C8x C 25.9152 -16.0180
13 C8x C 24.7026 -15.3182
14 C8x C 23.4694 -16.0305
15 C8x C 23.4696 -17.4305
16 C8x C 25.8946 -21.6300
17 C8x C 27.1070 -22.3300
18 C8x C 28.3195 -21.6300
19 C8x C 28.3195 -20.2300
20 C1a C 27.1070 -18.1301
BOND 20
1 2 3 1
2 3 4 1
3 4 5 1
4 5 6 1
5 6 7 1
6 7 8 1
7 8 9 1
8 7 10 1
9 10 11 1
10 11 12 2
11 12 13 1
12 13 14 2
13 14 15 1
14 10 15 2
15 8 16 2
16 16 17 1
17 17 18 2
18 18 19 1
19 19 9 2
20 9 20 1
|
|---|
