| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2011 | 21 | Yes |
Popular Name: 2-[(3-pyrrolidin-1-ylpropylamino)methyl]pyrido[1,2-a]pyrimidin-4-one 2-[(3-pyrrolidin-1-ylpropylamino…
| 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) | 1.55 | 6.94 | -42.8 | 2 | 5 | 1 | 51 | 287.387 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 7.34 | -83.06 | 3 | 5 | 2 | 52 | 288.395 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 8.75 | -199.01 | 4 | 5 | 3 | 57 | 289.403 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 8.32 | -111.99 | 3 | 5 | 2 | 55 | 288.395 | 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-[(3-pyrrolidinopropylamino)methyl]pyrido[1,2-a]pyrimidin-4-one](http://zinc12.docking.org/img/rings/190435.gif)