In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2011 | 19 | Yes |
Popular Name: 1-[3-[4-(2,2-difluoroethyl)piperazin-1-yl]propyl]pyrrolidin-2-one 1-[3-[4-(2,2-difluoroethyl)piper…
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) | 0.83 | 5.8 | -42.85 | 1 | 4 | 1 | 28 | 276.351 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.83 | 3.53 | -12.49 | 0 | 4 | 0 | 27 | 275.343 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.