| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 25 | Yes |
Popular Name: 2-[(1R)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-3H-quinazolin-4-one 2-[(1R)-1-(4-pyrimidin-2-ylpiper…
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) | 1.76 | 9.44 | -52.54 | 2 | 7 | 1 | 79 | 337.407 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 7.67 | -12.85 | 1 | 7 | 0 | 78 | 336.399 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 9.73 | -47.33 | 2 | 7 | 1 | 79 | 337.407 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[[4-(2-pyrimidyl)piperazino]methyl]-1H-quinazolin-4-one](http://zinc12.docking.org/img/rings/545785.gif)