| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 23 | No |
Popular Name: 2-[(3-methoxyphenyl)methylsulfanylmethyl]-9-methyl-pyrido[1,2-a]pyrimidin-4-one 2-[(3-methoxyphenyl)methylsulfan…
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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) | 3.81 | 10.25 | -15.18 | 0 | 4 | 0 | 44 | 326.421 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 10.58 | -34.18 | 1 | 4 | 1 | 45 | 327.429 | 5 | ↓ |
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-[(benzylthio)methyl]pyrido[1,2-a]pyrimidin-4-one](http://zinc12.docking.org/img/rings/177119.gif)