In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2011 | 22 | Yes |
Popular Name: 2-[4-(2,2-difluoroethyl)piperazin-1-yl]-N,N-diisobutyl-acetamide 2-[4-(2,2-difluoroethyl)piperazi…
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) | 2.40 | 5.76 | -10.13 | 0 | 4 | 0 | 27 | 319.44 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.40 | 8.08 | -38.64 | 1 | 4 | 1 | 28 | 320.448 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.40 | 8.01 | -36.04 | 1 | 4 | 1 | 28 | 320.448 | 8 | ↓ |