| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | Yes |
Popular Name: (2S)-N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-1,4-dioxane-2-carboxamide (2S)-N-[2-(6,7-dihydro-4H-thieno…
| 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) | 0.34 | 5.12 | -51.73 | 2 | 5 | 1 | 52 | 297.4 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.34 | 2.95 | -13.09 | 1 | 5 | 0 | 51 | 296.392 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.53 | 1.83 | -38.79 | 1 | 5 | 0 | 58 | 296.392 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4,5,6,7-tetrahydrothieno[3,2-c]pyridine](http://zinc12.docking.org/img/rings/1811.gif)
![N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-1,4-dioxane-2-carboxamide](http://zinc12.docking.org/img/rings/541358.gif)