| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 16 | Yes |
Popular Name: (3S,8aR)-3-(4-bromo-2-thienyl)-3,5,6,7,8,8a-hexahydro-2H-imidazo[1,5-a]pyridin-1-one (3S,8aR)-3-(4-bromo-2-thienyl)-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) | 2.60 | 2.68 | -30.86 | 1 | 3 | 0 | 40 | 301.209 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.41 | 3.05 | -6.68 | 1 | 3 | 0 | 32 | 301.209 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.41 | 5.23 | -40.35 | 2 | 3 | 1 | 34 | 302.217 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridine](http://zinc12.docking.org/img/rings/419598.gif)
![3-(2-thienyl)-3,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridine](http://zinc12.docking.org/img/rings/419597.gif)