| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2008 | 23 | Yes |
Popular Name: 7-methyl-2-[[(3S)-3-(trifluoromethyl)-1-piperidyl]methyl]pyrido[2,1-b]pyrimidin-4-one 7-methyl-2-[[(3S)-3-(trifluorome…
| 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) | 3.19 | 7.81 | -35.66 | 1 | 4 | 1 | 39 | 326.342 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.19 | 7.41 | -11.56 | 0 | 4 | 0 | 38 | 325.334 | 3 | ↓ |
![Pyrido[1,2-a]pyrimidin-4-one](http://zinc12.docking.org/img/rings/1379.gif)
![2-(piperidinomethyl)pyrido[1,2-a]pyrimidin-4-one](http://zinc12.docking.org/img/rings/27823.gif)
