| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2009 | 18 | Yes |
Popular Name: 2-[(4-amino-1-piperidyl)methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[(4-amino-1-piperidyl)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) | -0.08 | 1.37 | -53.99 | 4 | 5 | 1 | 77 | 265.362 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.38 | -1.32 | -74.91 | 3 | 5 | 0 | 80 | 264.354 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.08 | 3.25 | -50.39 | 4 | 5 | 1 | 76 | 265.362 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.08 | 3.57 | -125.27 | 5 | 5 | 2 | 78 | 266.37 | 2 | ↓ |
![3H-thieno[3,2-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/4166.gif)
![2-(piperidinomethyl)-3H-thieno[3,2-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/110662.gif)
