N-(2-aminoethyl)-5-(2-{[4-(morpholin-4-yl)pyridin-2-yl]amino}-1,3-thiazol-5-yl)pyridine-3-carboxamide (S25) Summary
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- N-(2-aminoethyl)-5-(2-{[4-(morpholin-4-yl)pyridin-2-yl]amino}-1,3-thiazol-5-yl)pyridine-3-carboxamide (S25) Summary
- Dihedrals
Dihedrals Table
| Dih. | Atom names | Experimental | Type |
|---|---|---|---|
| 1 | C.1-N.2-C3.7-C2.65-6-1-0 C.6-N.7-C3.2-C2.1 | 46.328 | Flexible Ring |
| 2 | C.1-N.2-C19.23-C14.1817-22-1-0 C.18-N.23-C19.2-C14.1 | 10.673 | Flexible |
| 3 | C.1-N.2-C19.23-C18.2221-22-1-0 C.22-N.23-C19.2-C18.1 | -172.545 | Flexible |
| 4 | C.1-C1.5-O.3-C2.65-2-4-0 C.6-C1.3-O.5-C2.1 | -65.921 | Flexible Ring |
| 5 | N.2-C.1-C1.5-O.32-4-0-1 N.3-C.5-C1.1-O.2 | 51.941 | Flexible Ring |
| 6 | N.2-C3.7-C2.6-O.32-5-6-1 N.3-C3.6-C2.7-O.2 | -53.511 | Flexible Ring |
| 7 | N.2-C19.23-C14.18-C15.1918-17-22-1 N.19-C19.18-C14.23-C15.2 | 177.047 | Rigid |
| 8 | N.2-C19.23-C18.22-C17.2120-21-22-1 N.21-C19.22-C18.23-C17.2 | -177.952 | Rigid |
| 9 | S.4-C10.14-N13.17-C12.1615-16-13-3 S.16-C10.17-N13.14-C12.4 | 1.192 | Rigid Ring |
| 10 | S.4-C10.14-N20.24-C17.2120-23-13-3 S.21-C10.24-N20.14-C17.4 | 0.654 | Flexible |
| 11 | S.4-C11.15-C4.8-C5.98-7-14-3 S.9-C11.8-C4.15-C5.4 | -7.969 | Flexible |
| 12 | S.4-C11.15-C4.8-C9.1312-7-14-3 S.13-C11.8-C4.15-C9.4 | 165.889 | Flexible |
| 13 | S.4-C11.15-C12.16-N13.1716-15-14-3 S.17-C11.16-C12.15-N13.4 | -0.286 | Rigid Ring |
| 14 | C1.5-C.1-N.2-C3.76-1-0-4 C1.7-C.2-N.1-C3.5 | -45.659 | Flexible Ring |
| 15 | C1.5-C.1-N.2-C19.2322-1-0-4 C1.23-C.2-N.1-C19.5 | 100.487 | Flexible |
| 16 | C1.5-O.3-C2.6-C3.76-5-2-4 C1.7-O.6-C2.3-C3.5 | 66.851 | Flexible Ring |
| 17 | C2.6-C3.7-N.2-C19.2322-1-6-5 C2.23-C3.2-N.7-C19.6 | -99.708 | Flexible |
| 18 | C3.7-N.2-C19.23-C14.1817-22-1-6 C3.18-N.23-C19.2-C14.7 | 157.766 | Flexible |
| 19 | C3.7-N.2-C19.23-C18.2221-22-1-6 C3.22-N.23-C19.2-C18.7 | -25.452 | Flexible |
| 20 | C4.8-C5.9-C6.10-C7.1110-9-8-7 C4.11-C5.10-C6.9-C7.8 | 0.484 | Rigid Ring |
| 21 | C4.8-C5.9-C6.10-C21.2524-9-8-7 C4.25-C5.10-C6.9-C21.8 | -179.8 | Rigid |
| 22 | C4.8-C9.13-N8.12-C7.1110-11-12-7 C4.11-C9.12-N8.13-C7.8 | 2.622 | Rigid Ring |
| 23 | C4.8-C11.15-S.4-C10.1413-3-14-7 C4.14-C11.4-S.15-C10.8 | -171.983 | Rigid |
| 24 | C4.8-C11.15-C12.16-N13.1716-15-14-7 C4.17-C11.16-C12.15-N13.8 | 171.876 | Rigid |
| 25 | C5.9-C4.8-C9.13-N8.1211-12-7-8 C5.12-C4.13-C9.8-N8.9 | -1.84 | Rigid Ring |
| 26 | C5.9-C4.8-C11.15-C12.1615-14-7-8 C5.16-C4.15-C11.8-C12.9 | -179.196 | Flexible |
| 27 | C5.9-C6.10-C7.11-N8.1211-10-9-8 C5.12-C6.11-C7.10-N8.9 | 0.434 | Rigid Ring |
| 28 | C5.9-C6.10-C21.25-O22.2625-24-9-8 C5.26-C6.25-C21.10-O22.9 | -174.899 | Flexible |
| 29 | C5.9-C6.10-C21.25-N23.2726-24-9-8 C5.27-C6.25-C21.10-N23.9 | 7.239 | Flexible |
| 30 | C6.10-C5.9-C4.8-C9.1312-7-8-9 C6.13-C5.8-C4.9-C9.10 | 0.152 | Rigid Ring |
| 31 | C6.10-C5.9-C4.8-C11.1514-7-8-9 C6.15-C5.8-C4.9-C11.10 | 173.967 | Rigid |
| 32 | C6.10-C7.11-N8.12-C9.1312-11-10-9 C6.13-C7.12-N8.11-C9.10 | -1.901 | Rigid Ring |
| 33 | C6.10-C21.25-N23.27-C24.2827-26-24-9 C6.28-C21.27-N23.25-C24.10 | 179.225 | Rigid |
| 34 | C7.11-C6.10-C21.25-O22.2625-24-9-10 C7.26-C6.25-C21.10-O22.11 | 4.821 | Flexible |
| 35 | C7.11-C6.10-C21.25-N23.2726-24-9-10 C7.27-C6.25-C21.10-N23.11 | -173.041 | Flexible |
| 36 | N8.12-C7.11-C6.10-C21.2524-9-10-11 N8.25-C7.10-C6.11-C21.12 | -179.302 | Rigid |
| 37 | N8.12-C9.13-C4.8-C11.1514-7-12-11 N8.15-C9.8-C4.13-C11.12 | -175.989 | Rigid |
| 38 | C9.13-C4.8-C11.15-C12.1615-14-7-12 C9.16-C4.15-C11.8-C12.13 | -5.338 | Flexible |
| 39 | C10.14-S.4-C11.15-C12.1615-14-3-13 C10.16-S.15-C11.4-C12.14 | 0.771 | Rigid Ring |
| 40 | C10.14-N13.17-C12.16-C11.1514-15-16-13 C10.15-N13.16-C12.17-C11.14 | -0.577 | Rigid Ring |
| 41 | C10.14-N20.24-C17.21-N16.2019-20-23-13 C10.20-N20.21-C17.24-N16.14 | -7.14 | Flexible |
| 42 | C10.14-N20.24-C17.21-C18.2221-20-23-13 C10.22-N20.21-C17.24-C18.14 | 174.087 | Flexible |
| 43 | C11.15-S.4-C10.14-N13.1716-13-3-14 C11.17-S.14-C10.4-N13.15 | -1.169 | Rigid Ring |
| 44 | C11.15-S.4-C10.14-N20.2423-13-3-14 C11.24-S.14-C10.4-N20.15 | 178.616 | Rigid |
| 45 | C12.16-N13.17-C10.14-N20.2423-13-16-15 C12.24-N13.14-C10.17-N20.16 | -178.605 | Rigid |
| 46 | N13.17-C10.14-N20.24-C17.2120-23-13-16 N13.21-C10.24-N20.14-C17.17 | -179.573 | Flexible |
| 47 | C14.18-C15.19-N16.20-C17.2120-19-18-17 C14.21-C15.20-N16.19-C17.18 | 1.009 | Rigid Ring |
| 48 | C14.18-C19.23-C18.22-C17.2120-21-22-17 C14.21-C19.22-C18.23-C17.18 | -1.026 | Rigid Ring |
| 49 | C15.19-C14.18-C19.23-C18.2221-22-17-18 C15.22-C14.23-C19.18-C18.19 | 0.107 | Rigid Ring |
| 50 | C15.19-N16.20-C17.21-C18.2221-20-19-18 C15.22-N16.21-C17.20-C18.19 | -1.913 | Rigid Ring |
| 51 | C15.19-N16.20-C17.21-N20.2423-20-19-18 C15.24-N16.21-C17.20-N20.19 | 179.379 | Rigid |
| 52 | N16.20-C15.19-C14.18-C19.2322-17-18-19 N16.23-C15.18-C14.19-C19.20 | -0.109 | Rigid Ring |
| 53 | N16.20-C17.21-C18.22-C19.2322-21-20-19 N16.23-C17.22-C18.21-C19.20 | 2 | Rigid Ring |
| 54 | C19.23-C18.22-C17.21-N20.2423-20-21-22 C19.24-C18.21-C17.22-N20.23 | -179.197 | Rigid |
| 55 | C21.25-N23.27-C24.28-C25.2928-27-26-24 C21.29-N23.28-C24.27-C25.25 | -121.226 | Flexible |
| 56 | O22.26-C21.25-N23.27-C24.2827-26-24-25 O22.28-C21.27-N23.25-C24.26 | 1.531 | Rigid |
| 57 | N23.27-C24.28-C25.29-N26.3029-28-27-26 N23.30-C24.29-C25.28-N26.27 | 48.542 | Flexible |
Dihedrals Histogram