In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 7th, 2011 | 20 | Yes |
Popular Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-(2-ethoxyethyl)pyrrolidine (2R)-2-(2,3-dihydro-1,4-benzodio…
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) | 2.37 | 7.62 | -32.53 | 1 | 4 | 1 | 32 | 278.372 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 6.05 | -6.51 | 0 | 4 | 0 | 31 | 277.364 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.