| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 24 | Yes |
Popular Name: 4-[[4-(2,2-difluoroethyl)piperazin-1-yl]methyl]-7,8-dimethyl-chromen-2-one 4-[[4-(2,2-difluoroethyl)piperaz…
| 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) | 3.01 | 7.2 | -13.46 | 0 | 4 | 0 | 37 | 336.382 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.01 | 9.45 | -54.71 | 1 | 4 | 1 | 38 | 337.39 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
