| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2011 | 24 | Yes |
Popular Name: 4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-3-(3-pyridyl)-1,2,4-oxadiazol-5-one 4-[(4-oxopyrido[1,2-a]pyrimidin-…
| 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) | 1.20 | 7.66 | -20.07 | 0 | 8 | 0 | 95 | 321.296 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.20 | 8.05 | -40.47 | 1 | 8 | 1 | 97 | 322.304 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.20 | 8.62 | -112.13 | 2 | 8 | 2 | 98 | 323.312 | 3 | ↓ |
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)
![4-[(4-ketopyrido[1,2-a]pyrimidin-2-yl)methyl]-3-(3-pyridyl)-1,2,4-oxadiazol-5-one](http://zinc12.docking.org/img/rings/373816.gif)