| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 28 | No |
Popular Name: [2-[(3aR,7aR)-5-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]phenyl] [2-[(3aR,7aR)-5-methyl-1,3-dioxo…
| 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) | 5.38 | 13.27 | -14.46 | 0 | 5 | 0 | 64 | 440.293 | 4 | ↓ |
| Ref Reference (pH 7) | 5.38 | 12.85 | -12.81 | 0 | 5 | 0 | 64 | 440.293 | 4 | ↓ |
| Ref Reference (pH 7) | 5.38 | 12.88 | -12.76 | 0 | 5 | 0 | 64 | 440.293 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Benzoic Acid [2-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)phenyl] Ester](http://zinc12.docking.org/img/rings/41839.gif)