| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 20 | Yes |
Popular Name: (3S,7aR)-N-ethyl-3-phenyl-1,3,5,6,7,7a-hexahydropyrrolo[2,1-e]imidazole-2-sulfonamide (3S,7aR)-N-ethyl-3-phenyl-1,3,5,…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.70 | 4.28 | -42.26 | 2 | 5 | 1 | 54 | 296.416 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.70 | 4 | -44.76 | 1 | 5 | 0 | 56 | 295.408 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.70 | 1.85 | -10.08 | 1 | 5 | 0 | 53 | 295.408 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,5,6,7,7a-hexahydro-1H-pyrrolo[2,1-e]imidazole](http://zinc12.docking.org/img/rings/52807.gif)
![3-phenyl-2,3,5,6,7,7a-hexahydro-1H-pyrrolo[2,1-e]imidazole](http://zinc12.docking.org/img/rings/52806.gif)