Entry |
|
Name |
Prinaberel (USAN/INN) |
Formula |
C15H10FNO3
|
Exact mass |
271.0645
|
Mol weight |
271.24
|
Structure |

|
Class |
Hormonal agent
DG01584 Estrogen receptor agonist
DG01630 beta-Estrogen receptor agonist
|
Efficacy |
Anti-inflammatory, Estrogen receptor beta agonist |
Comment |
Treatment of arthritis
|
Target |
|
Pathway |
|
Brite |
Drug groups [BR:br08330]
Hormonal agent
DG01584 Estrogen receptor agonist
DG01630 beta-Estrogen receptor agonist
D06631 Prinaberel
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
Estrogen receptor
NR3A2 (ESR2)
D06631 Prinaberel (USAN/INN)
|
Other DBs |
|
KCF data |
ATOM 20
1 C8x C 16.5900 -19.3900
2 C8y C 16.5900 -17.9900
3 C8x C 17.7800 -17.2900
4 C8y C 19.0400 -17.9900
5 C8y C 19.0400 -19.3900
6 C8y C 17.7800 -20.0900
7 N5x N 20.3700 -17.5700
8 C8y C 21.1400 -18.6900
9 O2x O 20.3700 -19.8100
10 C8y C 22.5400 -18.6900
11 C8x C 23.2400 -19.9024
12 C8y C 24.6400 -19.9024
13 C8y C 25.3400 -18.6900
14 C8x C 24.6400 -17.4776
15 C8x C 23.2400 -17.4776
16 O1a O 26.7400 -18.6900
17 C2b C 17.7628 -21.4899
18 O1a O 15.3747 -17.2949
19 X F 25.3304 -21.0979
20 C2a C 18.9792 -22.2124
BOND 22
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 2
9 8 9 1
10 5 9 1
11 8 10 1
12 10 11 2
13 11 12 1
14 12 13 2
15 13 14 1
16 14 15 2
17 10 15 1
18 13 16 1
19 6 17 1
20 2 18 1
21 12 19 1
22 17 20 2
|