| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 25 | No |
Popular Name: N-cyclopentyl-3-(5-oxo-1-thioxo-2H-[1,2,4]triazolo[4,3-a]quinazolin-4-yl)propanamide N-cyclopentyl-3-(5-oxo-1-thioxo-…
| 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) | 2.37 | 10.24 | -43.79 | 1 | 7 | -1 | 81 | 356.431 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | 10.25 | -12.17 | 2 | 7 | 0 | 84 | 357.439 | 4 | ↓ |
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)
![N-cyclopentyl-3-(5-keto-[1,2,4]triazolo[4,3-a]quinazolin-4-yl)propionamide](http://zinc12.docking.org/img/rings/404124.gif)