| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 24 | No |
Popular Name: 5-[(2S,3aR,4S,7aR)-4-[(E)-oct-1-enyl]-2,3,3a,4,5,6,7,7a-octahydrobenzofuran-2-yl]pentanoic 5-[(2S,3aR,4S,7aR)-4-[(E)-oct-1-…
| 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) | 6.08 | 13.54 | -45.22 | 0 | 3 | -1 | 49 | 335.508 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 6.08 | 11.57 | -5.76 | 1 | 3 | 0 | 47 | 336.516 | 11 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
