| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2010 | 23 | No |
Popular Name: (3aS,7aR)-2-[(2-oxo-1H-quinolin-4-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione (3aS,7aR)-2-[(2-oxo-1H-quinolin-…
| 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) | 1.36 | 6.63 | -11.47 | 1 | 5 | 0 | 70 | 308.337 | 2 | ↓ |
| Ref Reference (pH 7) | 1.36 | 6.64 | -11.95 | 1 | 5 | 0 | 70 | 308.337 | 2 | ↓ |
| Ref Reference (pH 7) | 1.36 | 6.61 | -11.4 | 1 | 5 | 0 | 70 | 308.337 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[(2-keto-1H-quinolin-4-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-quinone](http://zinc12.docking.org/img/rings/511584.gif)