| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 21 | Yes |
Popular Name: 2-[(6-amino-3-pyridyl)sulfanylmethyl]-7-chloro-pyrido[1,2-a]pyrimidin-4-one 2-[(6-amino-3-pyridyl)sulfanylme…
| 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) | 2.70 | 6.64 | -12.18 | 2 | 5 | 0 | 73 | 318.789 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.70 | 7.1 | -39.95 | 3 | 5 | 1 | 75 | 319.797 | 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)
![2-[(3-pyridylthio)methyl]pyrido[1,2-a]pyrimidin-4-one](http://zinc12.docking.org/img/rings/545821.gif)