| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 24th, 2011 | 29 | 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) | 3.23 | 11.84 | -39.4 | 3 | 7 | 1 | 82 | 411.555 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 9.84 | -15.04 | 2 | 7 | 0 | 81 | 410.547 | 4 | ↓ |
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-(azepan-1-yl)-6-[[5-(2-thienyl)-1H-pyrazol-4-yl]methyl]-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/172694.gif)