Entry |
|
Name |
Sarmazenil (INN); Sarmazol [veterinary] (TN) |
Formula |
C15H14ClN3O3
|
Exact mass |
319.0724
|
Mol weight |
319.743
|
Structure |
|
Simcomp |
|
Efficacy |
Antidote (benzodiazepines) |
Target |
|
Pathway |
hsa04080 | Neuroactive ligand-receptor interaction |
|
Brite |
Target-based classification of drugs [BR:br08310]
Ion channels
Ligand-gated ion channels
GABA (ionotropic)
GABR
D08507 Sarmazenil (INN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 22
1 C8y C 36.4666 -20.1095
2 N4y N 37.7334 -19.5231
3 C8y C 38.9897 -20.1421
4 C1x C 39.2852 -21.5005
5 C8y C 36.1405 -21.4802
6 N1y N 38.4072 -22.5943
7 C5x C 37.0058 -22.5812
8 C8x C 35.4491 -19.1479
9 C8x C 34.1076 -19.5482
10 C8x C 33.7815 -20.9189
11 C8y C 34.7990 -21.8806
12 X Cl 34.4679 -23.2724
13 O5x O 36.3812 -23.8506
14 C8y C 39.9667 -19.1386
15 N5x N 39.3142 -17.8993
16 C8x C 37.9339 -18.1369
17 C7a C 41.3698 -19.0845
18 O7a O 42.1277 -20.2873
19 O6a O 42.0121 -17.8659
20 C1b C 43.5400 -20.2908
21 C1a C 44.2409 -21.5119
22 C1a C 39.0167 -23.8811
BOND 24
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 1 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 5 11 2
13 11 12 1
14 7 13 2
15 3 14 2
16 14 15 1
17 15 16 2
18 2 16 1
19 14 17 1
20 17 18 1
21 17 19 2
22 18 20 1
23 20 21 1
24 6 22 1
|