| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2004 | 29 | Yes |
Popular Name: 4-allyl-1-[[3-(trifluoromethyl)benzyl]thio]-[1,2,4]triazolo[4,3-a]quinazolin-5-one 4-allyl-1-[[3-(trifluoromethyl)b…
| 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) | 4.91 | 4.91 | -12.35 | 0 | 5 | 0 | 52 | 416.428 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4H-[1,2,4]triazolo[4,3-a]quinazolin-5-one](http://zinc12.docking.org/img/rings/2049.gif)
![1-(benzylthio)-4H-[1,2,4]triazolo[4,3-a]quinazolin-5-one](http://zinc12.docking.org/img/rings/143392.gif)