| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 21 | No |
Popular Name: (3aS,7aR)-2-[3-(2-aminoethoxy)phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione (3aS,7aR)-2-[3-(2-aminoethoxy)ph…
| 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) | 1.04 | 4.86 | -46.84 | 3 | 5 | 1 | 74 | 287.339 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.04 | 4.43 | -10 | 2 | 5 | 0 | 73 | 286.331 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
