| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 5th, 2011 | 32 | Yes |
| 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) | 3.30 | 13.38 | -47.95 | 2 | 6 | 1 | 68 | 435.592 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.30 | 11.09 | -20.06 | 1 | 6 | 0 | 67 | 434.584 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5,6,7,8-tetrahydro-3H-pyrido[4,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/51436.gif)
![2-(6-benzyl-4-keto-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-3-yl)-N-(2-cyclohexen-1-ylethyl)acetamide](http://zinc12.docking.org/img/rings/377260.gif)