4-{2-[(7-amino-2-furan-2-yl[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-yl)amino]ethyl}phenol (ZMA) Summary
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- 4-{2-[(7-amino-2-furan-2-yl[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-yl)amino]ethyl}phenol (ZMA) Summary
- Dihedrals
Dihedrals Table
| Dih. | Atom names | Experimental | Type |
|---|---|---|---|
| 1 | C1.1-C2.2-C3.3-O4.43-2-1-0 C1.4-C2.3-C3.2-O4.1 | 179.825 | Rigid |
| 2 | C1.1-C2.2-C3.3-C5.54-2-1-0 C1.5-C2.3-C3.2-C5.1 | 0.033 | Rigid Ring |
| 3 | C1.1-C7.7-C6.6-C5.54-5-6-0 C1.5-C7.6-C6.7-C5.1 | -6.377 | Rigid Ring |
| 4 | C1.1-C7.7-C8.8-C9.98-7-6-0 C1.9-C7.8-C8.7-C9.1 | -74.511 | Flexible |
| 5 | C2.2-C1.1-C7.7-C6.65-6-0-1 C2.6-C1.7-C7.1-C6.2 | 4.836 | Rigid Ring |
| 6 | C2.2-C1.1-C7.7-C8.87-6-0-1 C2.8-C1.7-C7.1-C8.2 | 176.346 | Rigid |
| 7 | C2.2-C3.3-C5.5-C6.65-4-2-1 C2.6-C3.5-C5.3-C6.2 | -1.586 | Rigid Ring |
| 8 | C3.3-C5.5-C6.6-C7.76-5-4-2 C3.7-C5.6-C6.5-C7.3 | 4.748 | Rigid Ring |
| 9 | O4.4-C3.3-C5.5-C6.65-4-2-3 O4.6-C3.5-C5.3-C6.4 | 178.625 | Rigid |
| 10 | C5.5-C6.6-C7.7-C8.87-6-5-4 C5.8-C6.7-C7.6-C8.5 | -177.574 | Rigid |
| 11 | C6.6-C7.7-C8.8-C9.98-7-6-5 C6.9-C7.8-C8.7-C9.6 | 96.909 | Flexible |
| 12 | C7.7-C1.1-C2.2-C3.32-1-0-6 C7.3-C1.2-C2.1-C3.7 | -1.631 | Rigid Ring |
| 13 | C7.7-C8.8-C9.9-N10.109-8-7-6 C7.10-C8.9-C9.8-N10.7 | -169.275 | Flexible |
| 14 | C8.8-C9.9-N10.10-C11.1110-9-8-7 C8.11-C9.10-N10.9-C11.8 | 76.326 | Flexible |
| 15 | C9.9-N10.10-C11.11-N12.1211-10-9-8 C9.12-N10.11-C11.10-N12.9 | -179.328 | Flexible |
| 16 | C9.9-N10.10-C11.11-N13.1312-10-9-8 C9.13-N10.11-C11.10-N13.9 | 1.017 | Flexible |
| 17 | N10.10-C11.11-N12.12-C18.1817-11-10-9 N10.18-C11.12-N12.11-C18.10 | -178.948 | Rigid |
| 18 | N10.10-C11.11-N13.13-C14.1413-12-10-9 N10.14-C11.13-N13.11-C14.10 | -178.636 | Rigid |
| 19 | C11.11-N12.12-C18.18-N16.1615-17-11-10 C11.16-N12.18-C18.12-N16.11 | -2.364 | Rigid Ring |
| 20 | C11.11-N12.12-C18.18-N19.1918-17-11-10 C11.19-N12.18-C18.12-N19.11 | -177.599 | Rigid Ring |
| 21 | C11.11-N13.13-C14.14-N15.1514-13-12-10 C11.15-N13.14-C14.13-N15.11 | -179.714 | Rigid |
| 22 | C11.11-N13.13-C14.14-N16.1615-13-12-10 C11.16-N13.14-C14.13-N16.11 | -2.511 | Rigid Ring |
| 23 | N12.12-C11.11-N13.13-C14.1413-12-10-11 N12.14-C11.13-N13.11-C14.12 | 1.716 | Rigid Ring |
| 24 | N12.12-C18.18-N16.16-C14.1413-15-17-11 N12.14-C18.16-N16.18-C14.12 | 1.601 | Rigid Ring |
| 25 | N12.12-C18.18-N16.16-N17.1716-15-17-11 N12.17-C18.16-N16.18-N17.12 | -179.134 | Rigid Ring |
| 26 | N12.12-C18.18-N19.19-C20.2019-18-17-11 N12.20-C18.19-N19.18-C20.12 | 178.195 | Rigid Ring |
| 27 | N13.13-C11.11-N12.12-C18.1817-11-10-12 N13.18-C11.12-N12.11-C18.13 | 0.703 | Rigid Ring |
| 28 | N13.13-C14.14-N16.16-N17.1716-15-13-12 N13.17-C14.16-N16.14-N17.13 | -178.258 | Rigid Ring |
| 29 | N13.13-C14.14-N16.16-C18.1817-15-13-12 N13.18-C14.16-N16.14-C18.13 | 0.895 | Rigid Ring |
| 30 | C14.14-N16.16-N17.17-C20.2019-16-15-13 C14.20-N16.17-N17.16-C20.14 | -178.671 | Rigid Ring |
| 31 | C14.14-N16.16-C18.18-N19.1918-17-15-13 C14.19-N16.18-C18.16-N19.14 | 177.661 | Rigid Ring |
| 32 | N15.15-C14.14-N16.16-N17.1716-15-13-14 N15.17-C14.16-N16.14-N17.15 | -1.216 | Rigid |
| 33 | N15.15-C14.14-N16.16-C18.1817-15-13-14 N15.18-C14.16-N16.14-C18.15 | 177.937 | Rigid |
| 34 | N16.16-N17.17-C20.20-N19.1918-19-16-15 N16.19-N17.20-C20.17-N19.16 | -0.463 | Rigid Ring |
| 35 | N16.16-N17.17-C20.20-C21.2120-19-16-15 N16.21-N17.20-C20.17-C21.16 | 178.552 | Rigid |
| 36 | N16.16-C18.18-N19.19-C20.2019-18-17-15 N16.20-C18.19-N19.18-C20.16 | 2.493 | Rigid Ring |
| 37 | N17.17-N16.16-C18.18-N19.1918-17-15-16 N17.19-N16.18-C18.16-N19.17 | -3.075 | Rigid Ring |
| 38 | N17.17-C20.20-N19.19-C18.1817-18-19-16 N17.18-C20.19-N19.20-C18.17 | -1.235 | Rigid Ring |
| 39 | N17.17-C20.20-C21.21-C22.2221-20-19-16 N17.22-C20.21-C21.20-C22.17 | 170.978 | Rigid |
| 40 | N17.17-C20.20-C21.21-O25.2524-20-19-16 N17.25-C20.21-C21.20-O25.17 | -13.327 | Rigid |
| 41 | C18.18-N16.16-N17.17-C20.2019-16-15-17 C18.20-N16.17-N17.16-C20.18 | 2.109 | Rigid Ring |
| 42 | C18.18-N19.19-C20.20-C21.2120-19-18-17 C18.21-N19.20-C20.19-C21.18 | 179.782 | Rigid |
| 43 | N19.19-C20.20-C21.21-C22.2221-20-19-18 N19.22-C20.21-C21.20-C22.19 | -10.07 | Rigid |
| 44 | N19.19-C20.20-C21.21-O25.2524-20-19-18 N19.25-C20.21-C21.20-O25.19 | 165.625 | Rigid |
| 45 | C20.20-C21.21-C22.22-C23.2322-21-20-19 C20.23-C21.22-C22.21-C23.20 | 179.078 | Rigid |
| 46 | C20.20-C21.21-O25.25-C24.2423-24-20-19 C20.24-C21.25-O25.21-C24.20 | -178.805 | Rigid |
| 47 | C21.21-C22.22-C23.23-C24.2423-22-21-20 C21.24-C22.23-C23.22-C24.21 | -2.399 | Rigid Ring |
| 48 | C21.21-O25.25-C24.24-C23.2322-23-24-20 C21.23-O25.24-C24.25-C23.21 | 0.965 | Rigid Ring |
| 49 | C22.22-C21.21-O25.25-C24.2423-24-20-21 C22.24-C21.25-O25.21-C24.22 | -2.729 | Rigid Ring |
| 50 | C22.22-C23.23-C24.24-O25.2524-23-22-21 C22.25-C23.24-C24.23-O25.22 | 0.956 | Rigid Ring |
| 51 | C23.23-C22.22-C21.21-O25.2524-20-21-22 C23.25-C22.21-C21.22-O25.23 | 3.298 | Rigid Ring |
Dihedrals Histogram