| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2008 | 23 | No |
Popular Name: (3aR,7aS)-2-[(5-phenylisoxazol-3-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione (3aR,7aS)-2-[(5-phenylisoxazol-3…
| 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) | 2.55 | 8.43 | -10.59 | 0 | 5 | 0 | 63 | 308.337 | 3 | ↓ |
| Ref Reference (pH 7) | 2.55 | 8.45 | -11.5 | 0 | 5 | 0 | 63 | 308.337 | 3 | ↓ |
| Ref Reference (pH 7) | 2.55 | 8.43 | -10.94 | 0 | 5 | 0 | 63 | 308.337 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[(5-phenylisoxazol-3-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-quinone](http://zinc12.docking.org/img/rings/230769.gif)