In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2011 | 18 | Yes |
Popular Name: 5-fluoro-3-methyl-7-piperazin-1-yl-1,3-benzoxazol-2-one 5-fluoro-3-methyl-7-piperazin-1-…
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) | 0.71 | 4.85 | -47.59 | 2 | 5 | 1 | 55 | 252.269 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.71 | 3.55 | -8.15 | 1 | 5 | 0 | 50 | 251.261 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.