| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 15 | Yes |
| 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) | 1.03 | 4.82 | -49.48 | 2 | 3 | 1 | 37 | 225.337 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.03 | 3.51 | -7.55 | 1 | 3 | 0 | 32 | 224.329 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-[2-(3-thienyl)ethyl]piperazin-2-one](http://zinc12.docking.org/img/rings/447649.gif)