| Entry |
|
|---|
| Name |
Sumecigrel (USAN/INN);
Vicagrel |
|---|
| Formula |
C18H18ClNO4S
|
|---|
| Exact mass |
379.0645
|
|---|
| Mol weight |
379.86
|
|---|
| Structure |
|
|---|
| Class |
Blood modifier agent
DG01809 P2Y12 receptor antagonist
|
|---|
| Efficacy |
Anticoagulant, Platelet aggregation inhibitor, Purinergic receptor P2Y12 antagonist |
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Drug groups [BR:br08330]
Blood modifier agent
DG01809 P2Y12 receptor antagonist
D12979 Sumecigrel
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Purine / pyrimidine
P2RY12
D12979 Sumecigrel (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
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|---|
| KCF data |
ATOM 25
1 C8x C 7.9100 -14.9100
2 C8x C 7.9100 -13.5100
3 C8x C 9.1000 -12.8100
4 C8y C 10.3600 -13.5100
5 C8y C 10.3600 -14.9100
6 C8x C 9.1000 -15.6100
7 X Cl 11.5500 -12.8100
8 C1c C 11.5500 -15.6100
9 N1y N 12.7400 -14.9100
10 C1x C 12.7400 -13.5100
11 C1x C 14.0000 -12.8100
12 C8y C 15.1900 -13.5100
13 C8y C 15.1900 -14.9100
14 C1x C 14.0000 -15.6100
15 S2x S 16.5200 -13.0900
16 C8y C 17.3600 -14.2100
17 C8x C 16.5200 -15.3300
18 O7a O 18.7600 -14.2100
19 C7a C 11.5500 -17.0100
20 O7a O 10.3600 -17.7100
21 O6a O 12.7400 -17.7100
22 C1a C 9.1419 -17.0199
23 C7a C 19.4600 -15.4224
24 C1a C 20.8598 -15.4224
25 O6a O 18.7696 -16.6179
BOND 27
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 4 7 1
8 5 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 2
14 13 14 1
15 9 14 1
16 12 15 1
17 15 16 1
18 16 17 2
19 13 17 1
20 16 18 1
21 8 19 1 #Down
22 19 20 1
23 19 21 2
24 20 22 1
25 18 23 1
26 23 24 1
27 23 25 2
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|---|
