In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2010 | 29 | Yes |
Popular Name: 4-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]-2H-phthalazin-1-one 4-[4-(5-chloro-2-fluoro-benzoyl)…
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) | 2.08 | 7.02 | -13.52 | 1 | 7 | 0 | 86 | 414.824 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 5.19 | -45.22 | 0 | 7 | -1 | 89 | 413.816 | 2 | ↓ |