| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 24 | Yes |
Popular Name: 2-[(4-methylpiperazin-1-yl)methyl]-5-phenyl-3H-thieno[3,2-e]pyrimidin-4-one 2-[(4-methylpiperazin-1-yl)methy…
| 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) | 2.27 | 7.61 | -48.24 | 2 | 5 | 1 | 53 | 341.46 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 7.45 | -51.86 | 2 | 5 | 1 | 53 | 341.46 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 5.15 | -12.88 | 1 | 5 | 0 | 52 | 340.452 | 3 | ↓ |
![3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/3143.gif)
![5-phenyl-2-(piperazinomethyl)-3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/43142.gif)
