| Entry |
|
|---|
| Name |
Tamolarizine hydrochloride (JAN) |
|---|
| Formula |
C27H32N2O3. 2HCl
|
|---|
| Exact mass |
504.1946
|
|---|
| Mol weight |
505.47
|
|---|
| Structure |
|
|---|
| Efficacy |
Vasodilator (cerebral), Calcium channel blocker |
|---|
| Target |
|
|---|
| Pathway |
| hsa04270 | Vascular smooth muscle contraction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Ion channels
Voltage-gated ion channels
Calcium channels
CACNA1-L
D11102 Tamolarizine hydrochloride (JAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 34
1 C8x C 10.6400 -21.7700
2 C8x C 11.8300 -21.0700
3 C8y C 11.8300 -19.6700
4 C8x C 10.5700 -18.9700
5 C8x C 9.3800 -19.6700
6 C8x C 9.3800 -21.0700
7 C1c C 13.0200 -18.9000
8 C8y C 14.2800 -19.6000
9 N1y N 13.0200 -17.5700
10 C8x C 14.2800 -21.0000
11 C8x C 15.4700 -21.7000
12 C8x C 16.6600 -21.0000
13 C8x C 16.6600 -19.6000
14 C8x C 15.4700 -18.9000
15 C1x C 14.2100 -16.8000
16 C1x C 14.2100 -15.4000
17 N1y N 13.0200 -14.7700
18 C1x C 11.7600 -15.4700
19 C1x C 11.7600 -16.8700
20 C1b C 13.0200 -13.3700
21 C1c C 14.2100 -12.6700
22 O1a O 15.4000 -13.3700
23 C8y C 14.2100 -11.2700
24 C8x C 15.4000 -10.5700
25 C8y C 15.4000 -9.1700
26 C8y C 14.2100 -8.4700
27 C8x C 13.0200 -9.1700
28 C8x C 13.0200 -10.5700
29 O2a O 14.2100 -7.0700
30 O2a O 16.6153 -8.4749
31 C1a C 17.8037 -9.1677
32 C1a C 15.4224 -6.3700
33 X Cl 18.9700 -16.8700
34 X Cl 18.9700 -16.8700
BOND 35
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 3 7 1
8 7 8 1
9 7 9 1
10 8 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 8 14 1
16 9 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 9 19 1
22 17 20 1
23 21 22 1
24 21 20 1
25 21 23 1
26 23 24 2
27 24 25 1
28 25 26 2
29 26 27 1
30 27 28 2
31 23 28 1
32 26 29 1
33 25 30 1
34 30 31 1
35 29 32 1
BRACKET 1 17.2900 -17.7100 17.2900 -15.6100
1 20.0200 -15.6100 20.0200 -17.7100
1 2
ORIGINAL 1 33
REPEAT 1 34
|
|---|
