In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2011 | 26 | Yes |
Popular Name: N-[4-[[4-(2,2-difluoroethyl)piperazin-1-yl]methyl]-2-oxo-chromen-7-yl]acetamide N-[4-[[4-(2,2-difluoroethyl)pipe…
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) | 1.40 | 4.92 | -16.07 | 1 | 6 | 0 | 66 | 365.38 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 7.17 | -54.64 | 2 | 6 | 1 | 67 | 366.388 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.