| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 28 | No |
Popular Name: 2-[4-(2,2-difluoroethyl)piperazin-1-yl]-N-(7-nitro-3-oxo-4H-1,4-benzoxazin-6-yl)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) | 0.89 | 1.53 | -13.62 | 2 | 10 | 0 | 120 | 399.354 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.89 | 3.66 | -43.56 | 3 | 10 | 1 | 121 | 400.362 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.89 | 3.71 | -49.95 | 3 | 10 | 1 | 121 | 400.362 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
