| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 21 | Yes |
Popular Name: 3-[2-(3-pyridylmethylamino)ethyl]-1,2,3-benzotriazin-4-one 3-[2-(3-pyridylmethylamino)ethyl…
| 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) | 0.86 | 4.64 | -47.9 | 2 | 6 | 1 | 77 | 282.327 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 3.28 | -11.6 | 1 | 6 | 0 | 73 | 281.319 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[2-(3-pyridylmethylamino)ethyl]-1,2,3-benzotriazin-4-one](http://zinc12.docking.org/img/rings/74650.gif)