| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 27 | Yes |
Popular Name: 3-(4-oxo-1,2,3-benzotriazin-3-yl)-N-[5-(2-pyridyl)-4H-1,2,4-triazol-3-yl]propanamide 3-(4-oxo-1,2,3-benzotriazin-3-yl…
| 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) | 0.73 | 6.04 | -19.02 | 2 | 10 | 0 | 131 | 362.353 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.73 | 5.87 | -60.65 | 1 | 10 | -1 | 130 | 361.345 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 4.78 | -61.22 | 1 | 10 | -1 | 138 | 361.345 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-(4-keto-1,2,3-benzotriazin-3-yl)-N-[5-(2-pyridyl)-1H-1,2,4-triazol-3-yl]propionamide](http://zinc12.docking.org/img/rings/73300.gif)