| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 24th, 2009 | 29 | Yes |
Popular Name: (2R)-2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-1,1-dioxo-2,3-dihydrothiochromen-4-one (2R)-2-[3-[4-(4-fluorophenyl)pip…
| 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) | 3.16 | 9.71 | -55.42 | 1 | 5 | 1 | 59 | 417.526 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.16 | 7.48 | -14.15 | 0 | 5 | 0 | 58 | 416.518 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,1-diketo-2-[3-(4-phenylpiperazino)propyl]-2,3-dihydrothiochromen-4-one](http://zinc12.docking.org/img/rings/14479.gif)