| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2008 | 24 | No |
Popular Name: 5-[(3R)-dithiolan-3-yl]-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide 5-[(3R)-dithiolan-3-yl]-N-methyl…
| 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) | 2.67 | 9.91 | -21.47 | 1 | 5 | 0 | 66 | 383.564 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 8.8 | -57.84 | 0 | 5 | -1 | 69 | 382.556 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3H-thieno[3,2-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/4166.gif)
![5-(dithiolan-3-yl)-N-[(4-keto-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]valeramide](http://zinc12.docking.org/img/rings/108636.gif)