| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 21 | Yes |
Popular Name: (3S,7aR)-N-isobutyl-3-phenyl-1,3,5,6,7,7a-hexahydropyrrolo[2,1-e]imidazole-2-carboxamide (3S,7aR)-N-isobutyl-3-phenyl-1,3…
| 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) | 3.52 | 8.4 | -37.79 | 2 | 4 | 1 | 37 | 288.415 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.52 | 6.1 | -9.1 | 1 | 4 | 0 | 36 | 287.407 | 3 | ↓ |
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)