| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 27 | Yes |
Popular Name: 3-(6-methyl-4-oxo-pyrido[1,2-a]pyrimidine-3-carbonyl)-3,9-diazaspiro[5.6]dodecan-10-one 3-(6-methyl-4-oxo-pyrido[1,2-a]p…
| 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) | -0.13 | 6.11 | -25.8 | 1 | 7 | 0 | 84 | 368.437 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.13 | 6.56 | -59.79 | 2 | 7 | 1 | 85 | 369.445 | 1 | ↓ |
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)
![3,10-diazaspiro[5.6]dodecan-9-one](http://zinc12.docking.org/img/rings/521354.gif)
![3-(4-ketopyrido[1,2-a]pyrimidine-3-carbonyl)-3,10-diazaspiro[5.6]dodecan-9-one](http://zinc12.docking.org/img/rings/585240.gif)