| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 20 | No |
Popular Name: (3aS,7aR)-2-[(2S)-2-amino-2-phenyl-ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione (3aS,7aR)-2-[(2S)-2-amino-2-phen…
| 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) | -0.38 | 6.31 | -40.69 | 3 | 4 | 1 | 65 | 271.34 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.38 | 5.91 | -6.31 | 2 | 4 | 0 | 63 | 270.332 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
