| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 19 | No |
Popular Name: (3aS,7aR)-2-(3-ethynylphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione (3aS,7aR)-2-(3-ethynylphenyl)-3a…
| 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) | 2.44 | 8.42 | -8.9 | 0 | 3 | 0 | 37 | 253.301 | 1 | ↓ |
