| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 21 | Yes |
Popular Name: 2-[(3-amino-2-pyridyl)sulfanylmethyl]-5,6-dimethyl-1H-thieno[2,3-d]pyrimidin-4-one 2-[(3-amino-2-pyridyl)sulfanylme…
| 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) | 2.18 | 4.73 | -11.34 | 3 | 5 | 0 | 85 | 318.427 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.63 | 2.42 | -51.04 | 2 | 5 | -1 | 88 | 317.419 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/3143.gif)
![2-[(2-pyridylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/207185.gif)