| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 21 | Yes |
Popular Name: 2-[[(4-methoxyphenyl)methylamino]methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[[(4-methoxyphenyl)methylamino…
| 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) | 1.86 | 3.9 | -14.47 | 2 | 5 | 0 | 67 | 301.371 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 1.28 | -49.94 | 1 | 5 | -1 | 70 | 300.363 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 5.27 | -62.02 | 3 | 5 | 1 | 72 | 302.379 | 5 | ↓ |
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)
![2-[(benzylamino)methyl]-3H-thieno[3,2-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/33896.gif)