| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | Yes |
Popular Name: 3-[2-[(6-amino-3-pyridyl)sulfanyl]ethyl]-1,3-benzoxazol-2-one 3-[2-[(6-amino-3-pyridyl)sulfany…
| 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) | 2.06 | 6.64 | -12.77 | 2 | 5 | 0 | 74 | 287.344 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.06 | 7.12 | -37.8 | 3 | 5 | 1 | 75 | 288.352 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[2-(3-pyridylthio)ethyl]-1,3-benzoxazol-2-one](http://zinc12.docking.org/img/rings/545936.gif)