| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 19 | Yes |
Popular Name: (2S,4R)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-ethyl-cyclohexanone (2S,4R)-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) | 3.25 | 10.47 | -36.99 | 1 | 2 | 1 | 22 | 278.441 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.25 | 8.75 | -6.38 | 0 | 2 | 0 | 20 | 277.433 | 3 | ↓ |
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)
![2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)cyclohexanone](http://zinc12.docking.org/img/rings/115360.gif)