| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 27 | Yes |
Popular Name: 9-methyl-2-[[4-methyl-2-(2,2,2-trifluoroethoxy)anilino]methyl]pyrido[1,2-a]pyrimidin-4-one 9-methyl-2-[[4-methyl-2-(2,2,2-t…
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| 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) | 4.31 | 9.51 | -34.07 | 2 | 5 | 1 | 57 | 378.374 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 9.15 | -14.35 | 1 | 5 | 0 | 56 | 377.366 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Pyrido[1,2-a]pyrimidin-4-one](http://zinc12.docking.org/img/rings/1379.gif)
![2-(anilinomethyl)pyrido[1,2-a]pyrimidin-4-one](http://zinc12.docking.org/img/rings/29575.gif)