| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2008 | 33 | No |
Popular Name: [2-[[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-phenyl-amino]-2-oxo-ethyl] [2-[[(3R)-1,1-dioxo-2,3-dihydrot…
| 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) | 4.85 | 10.2 | -18.62 | 1 | 7 | 0 | 101 | 471.575 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.85 | 11.09 | -58.85 | 0 | 7 | -1 | 104 | 470.567 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Benzoic Acid [2-(N-(1,1-diketo-2,3-dihydrothiophen-3-yl)anilino)-2-keto-ethyl] Ester](http://zinc12.docking.org/img/rings/102995.gif)