| Entry |
|
|---|
| Name |
Ronacaleret hydrochloride (USAN) |
|---|
| Formula |
C25H31F2NO4. HCl
|
|---|
| Exact mass |
483.1988
|
|---|
| Mol weight |
483.97
|
|---|
| Structure |
|
|---|
| Efficacy |
Osteoporosis agent, Calcium-sensing receptor antagonist |
|---|
| Comment |
Treatment of osteoporosis
|
|---|
| Target |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Metabotropic glutamate receptor family
Calcium-sensing
CASR
D08991 Ronacaleret hydrochloride (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
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| KCF data |
ATOM 33
1 C8x C 12.9500 -16.2400
2 C8x C 12.9500 -17.6400
3 C8x C 14.1624 -18.3400
4 C8y C 15.3749 -17.6400
5 C8y C 15.3749 -16.2400
6 C8x C 14.1624 -15.5400
7 C1x C 16.7064 -18.0726
8 C1y C 17.5293 -16.9400
9 C1x C 16.7064 -15.8074
10 C1b C 18.7124 -17.6400
11 C1d C 19.9249 -16.9400
12 N1b N 21.1373 -17.6400
13 C1b C 22.3497 -16.9400
14 C1c C 23.5622 -17.6400
15 C1b C 24.7746 -16.9400
16 O2a O 25.9870 -17.6400
17 C8y C 27.1995 -16.9400
18 C8x C 28.4346 -17.6534
19 C8y C 29.6472 -16.9537
20 C8x C 29.6475 -15.5537
21 C8y C 28.4124 -14.8402
22 C8y C 27.1998 -15.5400
23 C1b C 30.8777 -17.6650
24 C1b C 32.0954 -16.9629
25 C6a C 33.3228 -17.6730
26 O6a O 34.5479 -16.9675
27 O6a O 33.3213 -19.0400
28 O1a O 23.5622 -19.0397
29 C1a C 20.6249 -15.7276
30 C1a C 19.2249 -15.7276
31 X F 28.4126 -13.4400
32 X F 26.0104 -14.8526
33 X Cl 37.4500 -16.8700
BOND 34
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 5 9 1
11 8 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 2
20 18 19 1
21 19 20 2
22 20 21 1
23 21 22 2
24 17 22 1
25 19 23 1
26 23 24 1
27 24 25 1
28 25 26 1
29 25 27 2
30 14 28 1 #Down
31 11 29 1
32 11 30 1
33 21 31 1
34 22 32 1
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|---|
