Entry |
|
Name |
Evatanepag (USAN/INN) |
Formula |
C25H28N2O5S
|
Exact mass |
468.1719
|
Mol weight |
468.57
|
Structure |

|
Simcomp |
|
Remark |
|
Efficacy |
Prostaglandin E2 receptor agonist |
Comment |
Non-prostanoid prostaglandin receptor agonist
Treatment of fracture
|
Target |
|
Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Prostaglandin
PTGER2
D09613 Evatanepag (USAN/INN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 33
1 C8y C 13.2300 -26.3200
2 C8x C 13.2300 -27.7200
3 C8x C 14.4424 -28.4200
4 C8y C 15.6549 -27.7200
5 C8x C 15.6549 -26.3200
6 C8x C 14.4424 -25.6200
7 C1b C 16.8860 -28.4310
8 N1c N 18.0912 -27.7353
9 C1b C 19.2735 -28.4181
10 C8y C 20.4675 -27.7288
11 C8x C 21.6554 -28.4148
12 C8x C 22.8679 -27.7149
13 C8x C 22.8681 -26.3149
14 C8y C 21.6801 -25.6289
15 C8x C 20.4676 -26.3288
16 C1d C 12.0176 -25.6200
17 C1a C 10.8221 -26.3104
18 C1a C 12.0175 -24.2202
19 C1a C 10.8051 -24.9200
20 S4a S 18.0917 -26.3204
21 C8y C 18.0917 -24.9204
22 O3c O 19.4917 -26.3204
23 O3c O 16.6917 -26.3204
24 C8x C 19.2803 -24.2338
25 C8x C 19.2800 -22.8338
26 C8x C 18.0674 -22.1340
27 N5x N 16.8788 -22.8206
28 C8x C 16.8791 -24.2206
29 O2a O 21.6801 -24.2201
30 C1b C 22.9074 -23.5114
31 C6a C 24.1104 -24.2060
32 O6a O 25.2940 -23.5227
33 O6a O 24.1107 -25.6197
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 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 14 15 1
16 10 15 2
17 1 16 1
18 16 17 1
19 16 18 1
20 16 19 1
21 8 20 1
22 20 21 1
23 20 22 2
24 20 23 2
25 21 24 2
26 24 25 1
27 25 26 2
28 26 27 1
29 27 28 2
30 21 28 1
31 14 29 1
32 29 30 1
33 30 31 1
34 31 32 1
35 31 33 2
|