| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2011 | 24 | Yes |
Popular Name: (2S)-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-3-methyl-2-pyrrolidin-1-yl-butanamide (2S)-N-[(6-fluoro-4H-1,3-benzodi…
| 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) | 2.24 | 7.45 | -33.84 | 2 | 5 | 1 | 52 | 337.415 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.24 | 5.26 | -8.67 | 1 | 5 | 0 | 51 | 336.407 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
