| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 21 | No |
Popular Name: (3aS,7aR)-2-(1,2,3,4-tetrahydroisoquinolin-7-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione (3aS,7aR)-2-(1,2,3,4-tetrahydroi…
| 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) | 1.73 | 5.89 | -7.39 | 1 | 4 | 0 | 49 | 282.343 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 7.25 | -44.95 | 2 | 4 | 1 | 54 | 283.351 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
