| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 21 | Yes |
Popular Name: 2-[(3-amino-2-pyridyl)sulfanylmethyl]-8-methyl-3H-quinazolin-4-one 2-[(3-amino-2-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) | 2.22 | 5.06 | -10.71 | 3 | 5 | 0 | 85 | 298.371 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.68 | 2.62 | -52.98 | 2 | 5 | -1 | 88 | 297.363 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[(2-pyridylthio)methyl]-3H-quinazolin-4-one](http://zinc12.docking.org/img/rings/207191.gif)