| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 23 | Yes |
Popular Name: 7-chloro-2-[[methyl-[(1R)-1-phenylethyl]amino]methyl]pyrido[2,1-b]pyrimidin-4-one 7-chloro-2-[[methyl-[(1R)-1-phen…
None
| 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) | 3.68 | 11.61 | -42.2 | 1 | 4 | 1 | 39 | 328.823 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.68 | 9.5 | -9.64 | 0 | 4 | 0 | 38 | 327.815 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.68 | 9.66 | -35.68 | 1 | 4 | 1 | 39 | 328.823 | 4 | ↓ |
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-[(benzylamino)methyl]pyrido[1,2-a]pyrimidin-4-one](http://zinc12.docking.org/img/rings/18421.gif)