| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2008 | 29 | No |
Popular Name: 2-[4-(3-phenyl-2-thioxo-1H-imidazole-4-carbonyl)piperazin-1-yl]-1-(1-piperidyl)ethanone 2-[4-(3-phenyl-2-thioxo-1H-imida…
None
| 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) | 1.08 | 11.13 | -68.41 | 2 | 7 | 1 | 66 | 414.555 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.08 | 8.92 | -24.63 | 1 | 7 | 0 | 65 | 413.547 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[4-(3-phenyl-2-thioxo-4-imidazoline-4-carbonyl)piperazino]-1-piperidino-ethanone](http://zinc12.docking.org/img/rings/106264.gif)