 | | DRUG: Amitraz | |
| Entry |
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| Name |
Amitraz (USP/INN) |
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| Formula |
C19H23N3
|
|---|
| Exact mass |
293.1892
|
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| Mol weight |
293.406
|
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| Structure |
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| Simcomp |
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| Remark |
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| Efficacy |
Scabicide, Octopamine receptor agonist |
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| Target |
Octopamine receptor [KO: K04165] |
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| Other DBs |
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| KCF data |
ATOM 22
1 C8y C 24.8766 -17.4376
2 C8x C 15.2332 -17.4587
3 C8y C 15.2332 -18.8541
4 C8x C 16.4458 -19.5485
5 C8y C 17.6443 -18.8541
6 C8y C 17.6443 -17.4587
7 C8x C 16.4458 -16.7573
8 N2b N 18.8450 -16.7573
9 C2b C 20.0514 -17.4516
10 N1c N 21.2578 -16.7502
11 C2b C 22.4640 -17.4446
12 N2b N 23.6702 -16.7433
13 C1a C 21.2545 -15.2152
14 C1a C 14.0240 -19.5492
15 C1a C 18.8543 -19.5477
16 C8y C 24.8784 -18.8297
17 C8x C 26.0917 -19.5282
18 C8y C 27.3032 -18.8266
19 C8x C 27.3015 -17.4345
20 C8x C 26.0881 -16.7360
21 C1a C 23.6456 -19.5438
22 C1a C 28.5156 -19.5245
BOND 23
1 5 6 1
2 6 7 2
3 7 2 1
4 6 8 1
5 8 9 2
6 9 10 1
7 10 11 1
8 11 12 2
9 12 1 1
10 10 13 1
11 3 14 1
12 2 3 2
13 5 15 1
14 3 4 1
15 4 5 2
16 1 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 19 20 2
21 1 20 1
22 16 21 1
23 18 22 1
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