| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 24 | Yes |
Popular Name: 2,4-dimethyl-6-[(8-methyl-4-oxo-3H-quinazolin-2-yl)methylsulfanyl]pyrimidine-5-carbonitrile 2,4-dimethyl-6-[(8-methyl-4-oxo-…
| 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) | 2.09 | 7.68 | -13.48 | 1 | 6 | 0 | 95 | 337.408 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.55 | 6.62 | -43.72 | 0 | 6 | -1 | 98 | 336.4 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[(4-pyrimidylthio)methyl]-3H-quinazolin-4-one](http://zinc12.docking.org/img/rings/124977.gif)