| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 14 | Yes |
Popular Name: (3S,7aS)-3-phenyl-2,3,5,6,7,7a-hexahydro-1H-pyrrolo[2,1-e]imidazole (3S,7aS)-3-phenyl-2,3,5,6,7,7a-h…
Find On: PubMed — Wikipedia — Google
CAS Number: N/A
| 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) | 1.95 | 6.56 | -114.14 | 3 | 2 | 2 | 21 | 190.29 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.95 | 3.92 | -16.79 | 1 | 2 | 0 | 19 | 188.274 | 1 | ↓ |
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)