| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 2nd, 2011 | 23 | Yes |
Popular Name: 2-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidin-1-yl]-N,N-diethyl-acetamide 2-[(2S)-2-(2,3-dihydro-1,4-benzo…
| 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) | 2.11 | 8.98 | -33.26 | 1 | 5 | 1 | 43 | 319.425 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.11 | 7.63 | -9.6 | 0 | 5 | 0 | 42 | 318.417 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
